SCHEMBL22042469

SCHEMBL22042469

COc1c(Cl)cnnc1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 3/20 0.33
GAA P10253 2/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 2/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL30500503 1.00 ALDH1A1 (0.33) ALDH1A1KDM4EGAAKMT2AHSD17B10
SCHEMBL30500454 0.82 ALDH1A1 (0.37) ALDH1A1KDM4EKMT2AHSD17B10HPGD
SCHEMBL14973641 0.82 ALDH1A1 (0.37) ALDH1A1KDM4EKMT2AHSD17B10HPGD
SCHEMBL30500502 0.79 ALDH1A1 (0.33) ALDH1A1KDM4EGAAKMT2AHSD17B10
SCHEMBL22978545 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EHPGD
SCHEMBL30698353 0.77 GAA (0.33) ALDH1A1KDM4EGAAKMT2AHSD17B10
SCHEMBL29683105 0.73 KDM4E (0.30) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL29682828 0.71 KDM4E (0.31) ALDH1A1KDM4EHSD17B10
SCHEMBL29682901 0.71 PDE4A (0.32)
SCHEMBL3652695 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250179059-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-06-05 US disclosed
US-12162870-B2 Anticancer compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-10 US disclosed
EP-4351560-A1 ANTICANCER COMPOUNDS The Regents of the University of California (US) 2024-04-17 EP disclosed
CN-117794525-A Anticancer compounds 加利福尼亚大学董事会 2024-03-29 CN disclosed
CN-116669727-A Triazole-pyridinyl substituted azacyclohexylacetic acid compounds as LPA receptor antagonists 唯久生物有限公司 2023-08-29 CN disclosed
EP-4196220-A1 TRIAZOLE-PYRIDINYL SUBSTITUTED AZACYCLOHEXYL ACETIC ACID COMPOUNDS AS LPA RECEPTOR ANTAGONISTS Viva Star Biosciences Limited (HK) 2023-06-21 EP disclosed
US-20230025178-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-01-26 US disclosed
US-20230025178-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-01-26 US disclosed
WO-2022261204-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-12-15 WO disclosed
WO-2022261204-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-12-15 WO disclosed
WO-2022034568-A1 TRIAZOLE-PYRIDINYL SUBSTITUTED AZACYCLOHEXYL ACETIC ACID COMPOUNDS AS LPA RECEPTOR ANTAGONISTS VIVA STAR BIOSCIENCES LIMITED (CN) 2022-02-17 WO disclosed
WO-2020116662-A1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE 第一三共株式会社 2020-06-11 WO 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 (3 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-20250179059-A1 ANTICANCER COMPOUNDS BET1, BRD4, BICRA ALDH1A1 3346/4885KDM4E 682/4885GAA 953/4885
US-20230025178-A1 ANTICANCER COMPOUNDS BET1, BRD4, BICRA ALDH1A1 3346/4885KDM4E 682/4885GAA 953/4885
US-12162870-B2 Anticancer compounds BET1, BRD4, BICRA ALDH1A1 3346/4885KDM4E 682/4885GAA 953/4885

“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.