SCHEMBL30642980

SCHEMBL30642980

FC1(F)CCN(c2cccc(Br)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.50
▸ GRIN3B O60391 1/20 0.50
▸ GRIN1 Q05586 1/20 0.50
▸ GRIN2A Q12879 1/20 0.50
▸ GRIN2B Q13224 1/20 0.50
▸ GRIN2C Q14957 1/20 0.50
▸ GRIN3A Q8TCU5 1/20 0.50
▸ CNR2 P34972 1/20 0.43
▸ DRD2 P14416 2/20 0.41
▸ DRD3 P35462 2/20 0.41
▸ ALOX5 P09917 2/20 0.41
▸ TRPV3 Q8NET8 1/20 0.40
▸ HTR3E A5X5Y0 5/20 0.40
▸ HTR3B O95264 5/20 0.40
▸ HTR3A P46098 5/20 0.40
▸ HTR3D Q70Z44 5/20 0.40
▸ HTR3C Q8WXA8 5/20 0.40
▸ ACACB O00763 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.37
▸ ALDH1A1 P00352 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
SCHEMBL17619976 1.00 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL23967086 0.82 GRIN2D (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7387291 0.80 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30569560 0.80 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29615080 0.80 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15321816 0.80 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL419024 0.80 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29898375 0.79 HTR3E (0.62) GRIN2BCNR2ALOX5TRPV3HTR3E
SCHEMBL30788618 0.79 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17609530 0.79 GRIN2D (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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4514790-A1 COMPOUNDS FOR INHIBITING KIF18A Volastra Therapeutics, Inc. (US) 2025-03-05 — — EP disclosed
CN-119451951-A Compounds for inhibition of KIF18A 沃拉斯查疗法公司 2025-02-14 — — CN disclosed
CN-118459440-A Preparation method and application of tetra-substituted aryl compound 江苏普莱医药生物技术有限公司 2024-08-09 — — CN disclosed
WO-2023212240-A1 COMPOUNDS FOR INHIBITING KIF18A VOLASTRA THERAPEUTICS, INC. (US) 2023-11-02 — — WO disclosed
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