SCHEMBL30410135

SCHEMBL30410135

NCc1cc2c3c(c1)C(=O)N(C1CCCNC1)C3CCC2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 12/20 0.37
▸ HTR3E A5X5Y0 1/20 0.37
▸ HTR3B O95264 1/20 0.37
▸ HTR3A P46098 1/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.37
▸ HTR3D Q70Z44 1/20 0.37
▸ HTR3C Q8WXA8 1/20 0.37
▸ HTR2C P28335 11/20 0.35
▸ HTR2A P28223 10/20 0.35
▸ PARP1 P09874 1/20 0.33
▸ RAD52 P43351 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ BMPR1A P36894 1/20 0.30
▸ ACVRL1 P37023 1/20 0.30
▸ ACVR1 Q04771 1/20 0.30

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
SCHEMBL25138136 0.76 CRBN (0.42) —
SCHEMBL2333387 0.69 HTR2B (0.49) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30410731 0.67 HTR2B (0.40) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30496975 0.67 PARP1 (0.50) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30410655 0.65 HTR2B (0.47) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30496990 0.61 PARP1 (0.45) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30496977 0.61 PARP1 (0.45) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30460068 0.60 HTR2B (0.49) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL25235039 0.60 HTR2B (0.49) HTR2BHTR3EHTR3BHTR3ATMEM97
SCHEMBL30132224 0.60 HTR2B (0.49) HTR2BHTR3EHTR3BHTR3ATMEM97

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-2023061478-A1 TRICYCLIC COMPOUND 先声再明医药有限公司 2023-04-20 — — WO disclosed
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