SCHEMBL14180976

SCHEMBL14180976

CCCCn1nc2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)cnn2c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 6/20 0.52
▸ AGTR1 P30556 2/20 0.39
▸ AGTR2 P50052 2/20 0.39
▸ GRM2 Q14416 1/20 0.39
▸ RAB9A P51151 5/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL14180765 0.88 CNR1 (0.56) CNR1RAB9ANPC1MEN1KMT2A
SCHEMBL14180980 0.86 CNR1 (0.60) CNR1AGTR1AGTR2CYP3A4
SCHEMBL4798404 0.86 CNR1 (0.54) CNR1RAB9ANPC1MEN1KMT2A
SCHEMBL14180888 0.85 CNR1 (0.58) CNR1RAB9ANPC1MEN1KMT2A
SCHEMBL4804815 0.84 CNR1 (0.52) CNR1AGTR1AGTR2RAB9ANPC1
SCHEMBL4804639 0.84 CNR1 (0.47) CNR1AGTR1AGTR2RAB9ANPC1
SCHEMBL4804647 0.84 CNR1 (0.47) CNR1AGTR1AGTR2RAB9ANPC1
SCHEMBL4798297 0.84 CNR1 (0.50) CNR1RAB9ANPC1MEN1KMT2A
SCHEMBL4800125 0.83 CNR1 (0.70) CNR1RAB9ANPC1MEN1KMT2A
SCHEMBL14180978 0.83 CNR1 (0.64) CNR1RAB9ANPC1MEN1KMT2A

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
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
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