SCHEMBL17074594

SCHEMBL17074594

CCCNc1cnn(C2CCCCC2)c(=O)c1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 10/20 1.00
▸ CNR1 P21554 3/20 0.68
▸ KDM4E B2RXH2 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ KAT2B Q92831 7/20 0.41
▸ GRM1 Q13255 1/20 0.40
▸ BPTF Q12830 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
SCHEMBL26014019 0.82 CNR2 (0.69) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL2324246 0.81 CNR2 (1.00) CNR2CNR1
SCHEMBL19000715 0.78 CNR2 (0.64) CNR2CNR1RAB9AGRM1
SCHEMBL15566620 0.75 CNR2 (0.59) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL26014006 0.75 CNR2 (0.60) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL26022933 0.75 CNR2 (0.60) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL9828687 0.74 CNR2 (0.60) CNR2CNR1RAB9ASMN1; SMN2GRM1
SCHEMBL26022888 0.73 CNR2 (0.57) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL10670539 0.73 CNR2 (0.57) CNR2CNR1RAB9ASMN1; SMN2KAT2B
SCHEMBL9240157 0.73 CNR2 (0.57) CNR2CNR1RAB9ASMN1; SMN2KAT2B

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-2957560-A1 PYRIDAZINE DERIVATIVES USEFUL AS CANNABINOID-2 AGONISTS ALLERGAN, INC. (US) 2015-12-23 — — EP disclosed
EP-2534137-B1 PYRIDAZINE DERIVATIVES USEFUL AS CANNABINOID-2 AGONISTS ALLERGAN INC (US) 2015-09-16 — — EP disclosed
Send feedback