SCHEMBL30657485

SCHEMBL30657485

COc1nc(Br)cc2c(O)ncnc12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
PDE5A O76074 1/20 0.30
EDNRA P25101 1/20 0.30
EGFR P00533 1/20 0.30
JAK3 P52333 1/20 0.30
MKNK1 Q9BUB5 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
SCHEMBL26639760 1.00 MEN1 (0.34) MEN1KMT2AMAPTATMPDE5A
SCHEMBL30657478 0.81 MEN1 (0.34) MEN1KMT2AMAPTPDE5A
SCHEMBL26639820 0.81 MEN1 (0.34) MEN1KMT2AMAPTPDE5A
SCHEMBL26639849 0.77 PDE4A (0.31)
SCHEMBL30657453 0.77 PDE4A (0.31)
SCHEMBL31364636 0.75 ALDH1A1 (0.30) KMT2A
SCHEMBL19878145 0.73 NQO2 (0.41) MEN1KMT2AMAPTATMPDE5A
SCHEMBL26639919 0.72 HRH4 (0.41) MEN1KMT2A
SCHEMBL30657462 0.72 HRH4 (0.41) MEN1KMT2A
SCHEMBL26639939 0.70 QDPR (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023215256-A1 SOS1 INHIBITORS AND USES THEREOF Revolution Medicines, Inc. (US) 2023-11-09 WO disclosed