SCHEMBL31541433

SCHEMBL31541433

FC1(F)CC2(CN(c3ccc(Br)cn3)C2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.43
▸ GRIN3B O60391 1/20 0.43
▸ GRIN1 Q05586 1/20 0.43
▸ GRIN2A Q12879 1/20 0.43
▸ GRIN2B Q13224 1/20 0.43
▸ GRIN2C Q14957 1/20 0.43
▸ GRIN3A Q8TCU5 1/20 0.43
▸ AKR1C3 P42330 1/20 0.40
▸ ACVR1 Q04771 1/20 0.38
▸ PANK3 Q9H999 1/20 0.36
▸ OGA O60502 1/20 0.36
▸ ACACB O00763 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ LCAT P04180 1/20 0.32
▸ CXCR3 P49682 1/20 0.32
▸ CHRM1 P11229 1/20 0.31

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
SCHEMBL17316625 0.86 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL21841807 0.79 AKR1C3 (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31541438 0.79 GRIN2D (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31641284 0.79 ACVR1 (0.32) ACVR1
SCHEMBL17316736 0.77 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31541401 0.77 ACVR1 (0.36) ACVR1ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL1929362 0.77 GRIN2D (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL21588465 0.76 AKR1C3 (0.51) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL23538930 0.75 AKR1C3 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31541411 0.75 AKR1C3 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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-2025061029-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF 3H PHARMACEUTICALS CO., LTD. (CN) 2025-03-27 — — WO disclosed
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