SCHEMBL29059782

SCHEMBL29059782

COc1ccc(C(=O)c2c(F)c(C(=O)c3ccc(Br)cc3)c3ccccn23)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
LMNA P02545 2/20 0.52
MAPK1 P28482 1/20 0.52
RAB9A P51151 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
TP53 P04637 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL30549316 0.88 KMT2A (0.54) MAPTKMT2AMEN1NPSR1RXFP1
SCHEMBL29059897 0.81 KDM4E (0.47) MAPTKMT2AMEN1MAPK1NPSR1
SCHEMBL28103003 0.76 MAPT (0.45) MAPTKMT2ALMNATP53KDM4E
SCHEMBL15184982 0.73 MAPT (0.52) MAPTKMT2AMEN1LMNARAB9A
SCHEMBL29547493 0.72 FNTA (0.54) MAPTKMT2AMEN1LMNAMAPK1
SCHEMBL1010096 0.72 RAB9A (1.00) MAPTKMT2AMEN1LMNAMAPK1
SCHEMBL29059749 0.71 ALDH1A1 (0.49) MAPTKMT2AMEN1MAPK1NPSR1
SCHEMBL29059951 0.71 MAPT (0.48) MAPTKMT2AMEN1MAPK1NPSR1
SCHEMBL15172903 0.70 FNTA (0.49) MAPTKMT2AMEN1NPSR1FNTA
Iodomethane SCHEMBL26988000 0.69 RAB9A (0.92) MAPTKMT2AMEN1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640135-A Preparation method of 3-carbonyl-2-fluoro substituted indolizine compound 平顶山学院 2023-08-25 CN claimed
CN-116640135-A Preparation method of 3-carbonyl-2-fluoro substituted indolizine compound 平顶山学院 2023-08-25 CN disclosed