SCHEMBL18623939

SCHEMBL18623939

CC(C)C(=O)CN1CCCN(CC(=O)O)CCN(CC(=O)O)CCCN(CC(=O)O)CC1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
SIGMAR1 Q99720 3/20 0.42
SLC6A9 P48067 1/20 0.38
NPC1 O15118 1/20 0.37
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36
GAA P10253 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
S1PR1 P21453 1/20 0.34
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21454476 1.00 HSD17B10 (0.42) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL21454477 0.98 HSD17B10 (0.44) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL10284339 0.94 HSD17B10 (0.47) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL21764427 0.94 HSD17B10 (0.47) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL20202265 0.94 HSD17B10 (0.47) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL24220956 0.94 HSD17B10 (0.47) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL21764630 0.93 SIGMAR1 (0.38) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL29299636 0.93 SIGMAR1 (0.38) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL15982293 0.92 SIGMAR1 (0.38) HSD17B10SIGMAR1SLC6A9NPC1CHRM5
SCHEMBL14487492 0.90 SIGMAR1 (0.44) SIGMAR1NPC1CHRM5CHRM3GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF RADIONETICS ONCOLOGY, INC. 2024-07-11 US disclosed
US-20230330275-A1 FAP-TARGETED RADIOPHARMACEUTICALS AND IMAGING AGENTS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE 2023-10-19 US disclosed
US-20230330275-A1 FAP-TARGETED RADIOPHARMACEUTICALS AND IMAGING AGENTS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE 2023-10-19 US disclosed
US-11746126-B2 Bicyclic peptide ligands with detectable moieties and uses thereof Bicyclerd Limited (GB) 2023-09-05 US disclosed
US-11746126-B2 Bicyclic peptide ligands with detectable moieties and uses thereof Bicyclerd Limited (GB) 2023-09-05 US disclosed
US-11707539-B2 FAP-targeted radiopharmaceuticals and imaging agents, and uses related thereto TRUSTEES OF TUFTS COLLEGE (US) 2023-07-25 US disclosed
US-11707539-B2 FAP-targeted radiopharmaceuticals and imaging agents, and uses related thereto TRUSTEES OF TUFTS COLLEGE (US) 2023-07-25 US disclosed
US-20220162241-A1 Chelated PSMA Inhibitors CANCER TARGETED TECH LLC (US) 2022-05-26 US disclosed
US-11225496-B2 Chelated PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2022-01-18 US disclosed
US-11147889-B2 Albumin-binding PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2021-10-19 US disclosed
US-20210079045-A1 BICYCLIC PEPTIDE LIGANDS WITH DETECTABLE MOIETIES AND USES THEREOF Bicyclerd Limited (GB) 2021-03-18 US disclosed
US-10919937-B2 Bicyclic peptide ligands and uses thereof BICYCLETX LIMITED (GB) 2021-02-16 US disclosed
US-20200131228-A1 BICYCLIC PEPTIDE LIGANDS AND USES THEREOF BICYCLETX LIMITED (GB) 2020-04-30 US disclosed
US-20200061218-A1 Albumin-Binding PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC 2020-02-27 US disclosed
US-20190309000-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC 2019-10-10 US disclosed
US-10166301-B2 Chelated PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2019-01-01 US disclosed
US-20180207298-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC 2018-07-26 US disclosed
US-9974869-B2 Chelated PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2018-05-22 US disclosed
US-20170072075-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC 2017-03-16 US disclosed
US-20170072075-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC 2017-03-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180207298-A1 Chelated PSMA Inhibitors FOLH1, KLK3, PSMA1 HSD17B10 3737/4885SIGMAR1 3316/4885SLC6A9 2709/4885
US-20220162241-A1 Chelated PSMA Inhibitors FOLH1, PSMA1, PSMA2 HSD17B10 2817/4885SIGMAR1 3119/4885SLC6A9 256/4885
US-20230330275-A1 FAP-TARGETED RADIOPHARMACEUTICALS AND IMAGING AGENTS, AND USES RELATED THERETO FAP, APC, FIBP HSD17B10 3607/4885SIGMAR1 4436/4885SLC6A9 4564/4885
US-11225496-B2 Chelated PSMA inhibitors FOLH1, PSMA1, PSMA2 HSD17B10 2817/4885SIGMAR1 3119/4885SLC6A9 256/4885
US-10166301-B2 Chelated PSMA inhibitors FOLH1, KLK3, PSMA1 HSD17B10 3737/4885SIGMAR1 3316/4885SLC6A9 2709/4885
US-11147889-B2 Albumin-binding PSMA inhibitors PSMA1, ALB, PSMA2 HSD17B10 3053/4885SIGMAR1 3315/4885SLC6A9 562/4885
US-20200131228-A1 BICYCLIC PEPTIDE LIGANDS AND USES THEREOF VIP, NGLY1, BID HSD17B10 4052/4885SIGMAR1 1240/4885SLC6A9 4691/4885
US-11707539-B2 FAP-targeted radiopharmaceuticals and imaging agents, and uses related thereto FAP, APC, FIBP HSD17B10 3607/4885SIGMAR1 4436/4885SLC6A9 4564/4885
US-11746126-B2 Bicyclic peptide ligands with detectable moieties and uses thereof VIP, NGLY1, GRPR HSD17B10 4114/4885SIGMAR1 1983/4885SLC6A9 4781/4885
US-20190309000-A1 Chelated PSMA Inhibitors FOLH1, PSMA1, PSMA2 HSD17B10 2817/4885SIGMAR1 3119/4885SLC6A9 256/4885
US-20170072075-A1 Chelated PSMA Inhibitors FOLH1, KLK3, PSMA1 HSD17B10 3737/4885SIGMAR1 3316/4885SLC6A9 2709/4885
US-10919937-B2 Bicyclic peptide ligands and uses thereof VIP, NGLY1, BID HSD17B10 4052/4885SIGMAR1 1240/4885SLC6A9 4691/4885
US-20210079045-A1 BICYCLIC PEPTIDE LIGANDS WITH DETECTABLE MOIETIES AND USES THEREOF VIP, NGLY1, GRPR HSD17B10 4114/4885SIGMAR1 1983/4885SLC6A9 4781/4885
US-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF NPY1R, NPY2R, NPY4R HSD17B10 3848/4885SIGMAR1 231/4885SLC6A9 2603/4885
US-20200061218-A1 Albumin-Binding PSMA Inhibitors PSMA1, ALB, PSMA2 HSD17B10 3053/4885SIGMAR1 3315/4885SLC6A9 562/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.