SCHEMBL30863517

SCHEMBL30863517

CN1CCC(c2ccc(C(=O)Nc3cccc4cnccc34)cc2C#N)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.51
▸ TRPV1 Q8NER1 5/20 0.48
▸ HTR1F P30939 3/20 0.46
▸ HTR1A P08908 2/20 0.46
▸ HTR1B P28222 2/20 0.46
▸ RORC P51449 8/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ GALK1 P51570 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ ATR Q13535 1/20 0.42
▸ HTR1D P28221 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
SCHEMBL27195745 1.00 CNR1 (0.51) CNR1TRPV1HTR1FHTR1AHTR1B
SCHEMBL27195727 0.87 CNR1 (0.53) CNR1TRPV1HTR1FHTR1AHTR1B
Hydrochloric Acid SCHEMBL30863459 0.87 CNR1 (0.57) CNR1TRPV1HTR1FHTR1AHTR1B
SCHEMBL27195735 0.85 CNR1 (0.51) CNR1TRPV1HTR1FHTR1AKDM4E
SCHEMBL27195713 0.84 HDAC6 (0.60) CNR1TRPV1HTR1FKDM4EMAPT
SCHEMBL30863479 0.76 TRPV1 (0.50) CNR1TRPV1KDM4EMAPT
SCHEMBL27195711 0.76 HDAC6 (0.60) CNR1TRPV1HTR1F
SCHEMBL27195706 0.76 TRPV1 (0.58) CNR1TRPV1
SCHEMBL27195702 0.75 CNR1 (0.48) CNR1TRPV1EPHX2
SCHEMBL30863450 0.75 TRPV1 (0.57) CNR1TRPV1KDM4EMAPTGALK1

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
EP-4581017-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS Biodol Therapeutics (FR) 2025-07-09 — — EP disclosed
WO-2024079072-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS BIODOL THERAPEUTICS (FR) 2024-04-18 — — WO disclosed
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