SCHEMBL7434832

SCHEMBL7434832

CCCCc1ccc(NC(=O)N2CCC(=O)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.57
▸ NPC1 O15118 5/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ KMT2A Q03164 2/20 0.55
▸ POLB P06746 1/20 0.52
▸ NPY5R Q15761 1/20 0.52
▸ LMNA P02545 1/20 0.51
▸ TRPV1 Q8NER1 1/20 0.51
▸ PDGFRB P09619 1/20 0.51
▸ HPGD P15428 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL7444797 0.83 NAMPT (0.61) NPC1RAB9AKMT2APOLBLMNA
SCHEMBL7429214 0.82 MEN1 (0.61) NPC1RAB9AKMT2APOLBHPGD
SCHEMBL6832529 0.80 RAB9A (0.52) NPC1RAB9AKMT2APOLBATM
SCHEMBL10252948 0.80 CNR2 (0.59) CNR2NPC1RAB9AKMT2APOLB
SCHEMBL26553954 0.79 POLB (0.55) CNR2NPC1RAB9AKMT2APOLB
SCHEMBL7434740 0.79 AVPR2 (0.53) KMT2AHPGDSMN1; SMN2
SCHEMBL7438084 0.78 NPC1 (0.71) NPC1RAB9AKMT2APOLBLMNA
Hydrochloric Acid SCHEMBL25402867 0.78 POLB (0.57) CNR2NPC1RAB9AKMT2APOLB
SCHEMBL9466324 0.77 RAB9A (0.63) NPC1RAB9AKMT2APOLBSMN1; SMN2
SCHEMBL26553911 0.77 SPHK1 (0.61) CNR2LMNA

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
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 — — US disclosed
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