SCHEMBL21189717

SCHEMBL21189717

CC(C)(C)SCCCCCCNCCNC(=O)NC(C)(C)C(=O)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.39
KDM4C Q9H3R0 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
CA3 P07451 2/20 0.31
CA5A P35218 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
PAOX Q6QHF9 1/20 0.31
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
EPHX2 P34913 5/20 0.30

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
SCHEMBL21189729 1.00 EPHX1 (0.39) EPHX1KDM4CSMN1; SMN2NPC1RAB9A
SCHEMBL21189728 0.99 EPHX1 (0.37) EPHX1KDM4CSMN1; SMN2NPC1RAB9A
SCHEMBL23589098 0.90 EPHX1 (0.38) EPHX1KDM4CSMN1; SMN2NPC1RAB9A
SCHEMBL23588852 0.90 EPHX1 (0.38) EPHX1KDM4C
SCHEMBL25004241 0.90 EPHX1 (0.38) EPHX1KDM4C
SCHEMBL22735813 0.87 EPHX1 (0.40) EPHX1KDM4CPAOX
SCHEMBL21365315 0.85 EPHX1 (0.41) EPHX1KDM4CCA3CA5ACA5B
SCHEMBL24194642 0.84 EPHX1 (0.38) EPHX1KDM4C
SCHEMBL22386557 0.80 SMN1; SMN2 (0.36) EPHX1SMN1; SMN2NPC1RAB9ACA3
SCHEMBL26616375 0.78 PAOX (0.32) PAOX

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11857603-B2 PTH compounds with low peak-to-trough ratios ASCENDIS PHARMA BONE DISEASES A/S (DK) 2024-01-02 US disclosed
US-20230381284-A1 Controlled-Release PTH Compound ASCENDIS PHARMA BONE DISEASES AS (DK) 2023-11-30 US disclosed
US-11793861-B2 PTH prodrugs ASCENDIS PHARMA BONE DISEASES A/S (DK) 2023-10-24 US disclosed
US-20230321198-A1 Dosage Regimen for a Controlled-Release PTH Compound ASCENDIS PHARMA BONE DISEASES AS (DK) 2023-10-12 US disclosed
US-11759504-B2 PTH compounds with low peak-to-trough ratios ASCENDIS PHARMA BONE DISEASES A/S (DK) 2023-09-19 US disclosed
US-11759504-B2 PTH compounds with low peak-to-trough ratios ASCENDIS PHARMA BONE DISEASES A/S (DK) 2023-09-19 US disclosed
US-20230121525-A1 PTH Prodrugs ASCENDIS PHARMA BONE DISEASES AS (DK) 2023-04-20 US disclosed
US-20230042670-A1 Hypoparathyroidism Treatment ASCENDIS PHARMA BONE DISEASES A/S (DK) 2023-02-09 US disclosed
US-20220008516-A1 PTH Prodrugs ASCENDIS PHARMA BONE DISEASES A/S (DK) 2022-01-13 US disclosed
US-20210196801-A1 Starting Dose of PTH Conjugates ASCENDIS PHARMA BONE DISEASES A/S (DK) 2021-07-01 US disclosed
US-20200376089-A1 PTH PRODRUGS ASCENDIS PHARMA BONE DISEASES A/S (DK) 2020-12-03 US disclosed
US-20200360488-A1 PTH COMPOUNDS WITH LOW PEAK-TO-TROUGH RATIOS ASCENDIS PHARMA BONE DISEASES A/S (DK) 2020-11-19 US disclosed
US-20200360487-A1 PTH PRODRUGS ASCENDIS PHARMA BONE DISEASES A/S (DK) 2020-11-19 US disclosed
US-20200276276-A1 PTH Prodrugs ASCENDIS PHARMA GMBH (DE) 2020-09-03 US disclosed
US-20190282668-A1 PTH Compounds with Low Peak-To-Trough Ratios ASCENDIS PHARMA BONE DISEASES A/S (DK) 2019-09-19 US disclosed
US-20190224329-A1 Incremental Dose Finding in Controlled-Release PTH Compounds ASCENDIS PHARMA BONE DISEASES A/S (DK) 2019-07-25 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-20200376089-A1 PTH PRODRUGS PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-20190224329-A1 Incremental Dose Finding in Controlled-Release PTH Compounds PTH1R, CALCA, CALCB EPHX1 2395/4885KDM4C 4498/4885SMN1; SMN2 4124/4885
US-20200276276-A1 PTH Prodrugs PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-11793861-B2 PTH prodrugs PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-20210196801-A1 Starting Dose of PTH Conjugates PTH1R, FGF23, PTMS EPHX1 1259/4885KDM4C 4104/4885SMN1; SMN2 3218/4885
US-20230121525-A1 PTH Prodrugs PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-11759504-B2 PTH compounds with low peak-to-trough ratios PTH1R, PTMS, FGF23 EPHX1 1814/4885KDM4C 4210/4885SMN1; SMN2 4438/4885
US-20190282668-A1 PTH Compounds with Low Peak-To-Trough Ratios PTH1R, PTMS, FGF23 EPHX1 1814/4885KDM4C 4210/4885SMN1; SMN2 4438/4885
US-20230381284-A1 Controlled-Release PTH Compound PTH1R, CALCA, CALCB EPHX1 2811/4885KDM4C 3997/4885SMN1; SMN2 3606/4885
US-20200360487-A1 PTH PRODRUGS PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-11857603-B2 PTH compounds with low peak-to-trough ratios PTH1R, PTMS, FGF23 EPHX1 1814/4885KDM4C 4210/4885SMN1; SMN2 4438/4885
US-20230321198-A1 Dosage Regimen for a Controlled-Release PTH Compound PTH1R, CALCB, AVPR2 EPHX1 3511/4885KDM4C 4616/4885SMN1; SMN2 3277/4885
US-20220008516-A1 PTH Prodrugs PTH1R, PTMS, PHPT1 EPHX1 878/4885KDM4C 2681/4885SMN1; SMN2 4852/4885
US-20230042670-A1 Hypoparathyroidism Treatment PTH1R, PTMS, CALCA EPHX1 2650/4885KDM4C 4218/4885SMN1; SMN2 4153/4885
US-20200360488-A1 PTH COMPOUNDS WITH LOW PEAK-TO-TROUGH RATIOS PTH1R, PTMS, FGF23 EPHX1 1814/4885KDM4C 4210/4885SMN1; SMN2 4438/4885

“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.