SCHEMBL8036136

SCHEMBL8036136

CNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 6/20 0.41
CHRM5 P08912 1/20 0.39
CHRM3 P20309 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
SLC6A9 P48067 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
ALOX15 P16050 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL13381316 1.00 HSD17B10 (0.47) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL10563724 0.98 HSD17B10 (0.45) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL24489899 0.94 ALDH1A1 (0.46) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL21764406 0.94 ALDH1A1 (0.46) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL21791334 0.92 ATM (0.44) HSD17B10ALDH1A1
SCHEMBL15199219 0.92 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2SIGMAR1NPC1
SCHEMBL13214851 0.91 ALDH1A1 (0.46) ALDH1A1CHRM5CHRM3SMN1; SMN2SIGMAR1
SCHEMBL25018192 0.91 KDM4E (0.44) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL24540412 0.89 HSD17B10 (0.39) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2
SCHEMBL12327463 0.89 HSD17B10 (0.39) HSD17B10ALDH1A1CHRM5CHRM3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4885363-A RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS E. R. SQUIBB & SONS, INC. (US) 1989-12-05 US claimed
EP-0292689-A2 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INTERNATIONAL B.V. (NL) 1988-11-30 EP claimed
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 US disclosed
US-20240207458-A1 TARGETED ALPHA PARTICLE THERAPY FOR SOMATOSTATIN RECEPTOR 2 POSITIVE NEUROENDOCRINE TUMORS AND METASTASES WAKE FOREST UNIVERSITY 2024-06-27 US disclosed
WO-2023239829-A2 SYSTEMS AND METHODS FOR ASSESSING DISEASE BURDEN AND PROGRESSION PROGENICS PHARMACEUTICALS, INC. (US) 2023-12-14 WO disclosed
US-11793895-B2 Residualizing linkers and uses thereof CENTRE FOR PROBE DEVELOPMENT AND COMMERCIALIZATION 2023-10-24 US disclosed
US-20230321285-A1 METHOD OF TREATING PSMA-EXPRESSING CANCERS NOVARTIS AG (CH) 2023-10-12 US disclosed
US-20230302164-A1 PSMA-Targeting Ligands With Optimal Properties for Imaging and Therapy WISCONSIN ALUMNI RESEARCH FOUNDATION 2023-09-28 US disclosed
US-20230173112-A1 PSMA-Targeting Ligands With Optimal Properties for Imaging and Therapy WISCONSIN ALUMNI RESEARCH FOUNDATION 2023-06-08 US disclosed
US-20230165981-A1 [161Tb]-BASED RADIOPEPTIDES UNIVERSITÄT BASEL (CH) 2023-06-01 US disclosed
US-20230098279-A1 METHOD OF TREATING PSMA-EXPRESSING CANCERS ENDOCYTE, INC. 2023-03-30 US disclosed
US-7321045-B2 Vitronectin receptor antagonist pharmaceuticals BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-01-22 US disclosed
WO-2005048810-A2 SIGMA-2 RECEPTOR RADIOTRACERS FOR IMAGING THE PROLIFERATIVE STATUS OF SOLID TUMORS WASHINGTON UNIVERSITY IN ST. LOUIS (US) 2005-06-02 WO disclosed
US-6143274-A IMAGING MAMMALIAN TISSUE UTILIZING A NON-IONIC COMPLEX OF A PARAMAGNETIC ION OF LANTHANIDE ELEMENT AND A MACROCYCLIC CHELATING AGENT BRACCO DIAGNOSTICS, INC. 2000-11-07 US disclosed
US-5846519-A Method for imaging mammalian tissue using 1-substituted-1,4,7-tricarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs BRACCO DIAGNOSTICS INC. (US) 1998-12-08 US disclosed
US-5674470-A Method for imaging mammalian tissue using 1-substituted- 4,7,10-tricarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs BRACCO DIAGNOSTICS INC. (US) 1997-10-07 US disclosed
EP-0292689-B1 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INT BV (NL) 1996-07-31 EP disclosed
US-5474756-A Chelate compound of a paramagnetic ion of lanthanide element BRACCO INTERNATIONAL B.V. (NL) 1995-12-12 US disclosed
US-4885363-A RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS E. R. SQUIBB & SONS, INC. (US) 1989-12-05 US disclosed
EP-0292689-A2 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INTERNATIONAL B.V. (NL) 1988-11-30 EP 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 (8 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-20230173112-A1 PSMA-Targeting Ligands With Optimal Properties for Imaging and Therapy PSMA1, PSMA2, FOLH1 HSD17B10 4201/4885ALDH1A1 1627/4885CHRM5 3664/4885
US-20230321285-A1 METHOD OF TREATING PSMA-EXPRESSING CANCERS IL15RA, IL15, CD274 HSD17B10 2970/4885ALDH1A1 818/4885CHRM5 2466/4885
US-20230098279-A1 METHOD OF TREATING PSMA-EXPRESSING CANCERS IL15RA, IL15, CD274 HSD17B10 3452/4885ALDH1A1 1201/4885CHRM5 2471/4885
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 HSD17B10 3923/4885ALDH1A1 2246/4885CHRM5 4855/4885
US-20230165981-A1 [161Tb]-BASED RADIOPEPTIDES SSTR1, SSTR4, SSTR3 HSD17B10 4233/4885ALDH1A1 4707/4885CHRM5 4546/4885
US-20240207458-A1 TARGETED ALPHA PARTICLE THERAPY FOR SOMATOSTATIN RECEPTOR 2 POSITIVE NEUROENDOCRINE TUMORS AND METASTASES SSTR2, SSTR1, SSTR5 HSD17B10 4476/4885ALDH1A1 4724/4885CHRM5 1831/4885
US-11793895-B2 Residualizing linkers and uses thereof CD44, CD47, MTCL3 HSD17B10 1339/4885ALDH1A1 619/4885CHRM5 3233/4885
US-20230302164-A1 PSMA-Targeting Ligands With Optimal Properties for Imaging and Therapy PSMA1, PSMA2, FOLH1 HSD17B10 4215/4885ALDH1A1 1479/4885CHRM5 3396/4885

“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.