SCHEMBL30710039

SCHEMBL30710039

COc1ccc(CN(Cc2ccc(OC)cc2)c2ccc(C(F)(F)F)c(Br)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 2/20 0.42
NOTUM Q6P988 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
PDK1 Q15118 1/20 0.39
CNR2 P34972 5/20 0.38
CNR1 P21554 4/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
APLNR P35414 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSPO P30536 1/20 0.37
EPHX2 P34913 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
AR P10275 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
SCHEMBL26694781 1.00 QPCT (0.42) QPCTNOTUMMEN1ALDH1A1GAA
SCHEMBL26694815 0.89 QPCT (0.42) QPCTMEN1ALDH1A1KMT2ACNR2
SCHEMBL31288430 0.89 QPCT (0.42) QPCTMEN1ALDH1A1KMT2ACNR2
SCHEMBL26694433 0.85 LMNA (0.39) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL30710150 0.85 LMNA (0.39) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL31491029 0.84 QPCT (0.43) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL31552005 0.84 QPCT (0.43) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL30709781 0.84 LMNA (0.38) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL26694457 0.84 LMNA (0.38) QPCTMEN1ALDH1A1GAAKMT2A
SCHEMBL31057607 0.80 QPCT (0.42) QPCTMEN1ALDH1A1GAAKMT2A

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
EP-4526309-A1 AZA-TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF Genentech, Inc. (US) 2025-03-26 EP disclosed
CN-119365467-A Aza-tetraepoxy aza compounds and uses thereof 基因泰克公司 2025-01-24 CN disclosed
WO-2024123102-A1 NOVEL TRICYCLIC COMPOUND AS KRAS G12D INHIBITOR, AND USE THEREOF 에스케이바이오팜 주식회사 2024-06-13 WO disclosed
WO-2023225302-A1 AZA-TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2023-11-23 WO disclosed