SCHEMBL31139720

SCHEMBL31139720

CCC(=O)N1N=C(c2cc(C)cs2)CC1c1ccc(C)cc1F

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ YAP1 P46937 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ TEAD4 Q15561 1/20 0.42
▸ LMNA P02545 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
SCHEMBL31139765 0.88 MEN1 (0.53) MEN1KMT2AKDM4ENPC1YAP1
SCHEMBL31139728 0.83 MEN1 (0.62) MEN1KMT2AKDM4E
SCHEMBL31139723 0.83 MEN1 (0.49) MEN1KMT2AKDM4E
SCHEMBL31139767 0.83 MEN1 (0.49) MEN1KMT2AKDM4E
SCHEMBL31139719 0.81 MEN1 (0.53) MEN1KMT2AKDM4ENPC1YAP1
SCHEMBL31139777 0.80 MEN1 (0.51) MEN1KMT2ANPC1YAP1RAB9A
SCHEMBL31139699 0.80 MEN1 (0.60) MEN1KMT2ANPC1YAP1RAB9A
SCHEMBL31139750 0.80 MEN1 (0.48) MEN1KMT2AKDM4ENPC1YAP1
SCHEMBL31139705 0.79 MEN1 (0.62) MEN1KMT2AKDM4ENPC1YAP1
SCHEMBL31139732 0.79 MEN1 (0.51) MEN1KMT2AKDM4ENPC1YAP1

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-118696034-A Novel bicyclic compounds as RAD51 inhibitors 萨提亚疗法股份有限公司 2024-09-24 — — CN claimed
CN-118696034-A Novel bicyclic compounds as RAD51 inhibitors 萨提亚疗法股份有限公司 2024-09-24 — — CN disclosed
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