SCHEMBL29593446

SCHEMBL29593446

C=Cc1ccc2c(cnn2C2CCCCO2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
CYP4F2 P78329 5/20 0.35
CYP4A11 Q02928 5/20 0.35
DGAT2 Q96PD7 1/20 0.31
YTHDC1 Q96MU7 1/20 0.31
RET P07949 1/20 0.31
KRAS P01116 1/20 0.30
MCL1 Q07820 1/20 0.30
ATR Q13535 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 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
SCHEMBL21379205 1.00 RXRA (0.41) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL26674874 0.89 RXRA (0.42) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL31437248 0.89 RXRA (0.42) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL27637483 0.83 RXRA (0.40) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL21195919 0.83 RXRA (0.41) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL21986721 0.83 RXRA (0.44) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL21198430 0.81 ALDH1A1 (0.45) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL806443 0.81 RXRA (0.43) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL768120 0.81 RXRA (0.43) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL31642472 0.81 RXRA (0.43) RXRARXRBRXRGALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119894872-A Heteroarenes, pharmaceutical compositions containing heteroarenes, and methods of use thereof 修复治疗公司 2025-04-25 CN disclosed
EP-4526293-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME Repare Therapeutics Inc. (CA) 2025-03-26 EP disclosed
WO-2023220831-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME REPARE THERAPEUTICS INC. (CA) 2023-11-23 WO disclosed
CN-110267957-B Quinazoline compounds 安斯泰来制药株式会社 2022-04-26 CN disclosed