SCHEMBL30965442

SCHEMBL30965442

COCOc1cc(Br)c2c(ccn2C)c1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
HTR2C P28335 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL29234949 1.00 MAPT (0.32) MAPTHTR2CKDM4EMEN1KMT2A
SCHEMBL6029602 0.84 MTNR1A (0.36) MAPTHTR2CKDM4EMEN1KMT2A
SCHEMBL6030519 0.71 KDM4E (0.38) KDM4E
SCHEMBL30231701 0.71 TNFRSF1A (0.30) MAPTKDM4E
SCHEMBL19616584 0.70 CYP1A2 (0.40) MAPTKDM4EMEN1KMT2A
SCHEMBL29909876 0.70 CYP1A2 (0.40) MAPTKDM4EMEN1KMT2A
SCHEMBL6030299 0.70 PRKCI (0.33) HTR2C
SCHEMBL3155327 0.69 CA2 (0.40) MAPTMEN1KMT2A
SCHEMBL23409334 0.69 CYP1A2 (0.35) MAPTKDM4EMEN1KMT2A
SCHEMBL29903159 0.69 CYP1A2 (0.35) MAPTKDM4EMEN1KMT2A

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
CN-118221698-A KRAS G12D inhibitors 艾立康药业股份有限公司 2024-06-21 CN disclosed