SCHEMBL17074606

SCHEMBL17074606

CC(C)(C)n1ncc(NCCN2CCOCC2)c(Cl)c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.61
▸ CNR1 P21554 2/20 0.61
▸ CA12 O43570 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ NSD2 O96028 1/20 0.45
▸ LMNA P02545 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ ATM Q13315 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
SCHEMBL17074608 0.79 CNR2 (0.56) CNR2CNR1MEN1KMT2ALMNA
SCHEMBL17074613 0.78 CA12 (0.62) CNR2CNR1CA12CA1CA2
SCHEMBL17074601 0.78 CNR2 (0.67) CNR2CNR1CA12CA1CA2
SCHEMBL9528164 0.77 HTR1A (0.58) —
SCHEMBL2323787 0.76 CNR2 (1.00) CNR2CNR1CA12CA1CA2
SCHEMBL17074597 0.76 CA12 (0.56) CNR2CNR1CA12CA1CA2
SCHEMBL10366655 0.75 SMN1; SMN2 (0.50) CNR2CNR1MEN1KMT2ALMNA
SCHEMBL17074611 0.75 CNR2 (0.69) CNR2CNR1CA12CA1CA2
SCHEMBL14739433 0.73 CNR1 (0.52) CNR2CNR1CA12CA1CA2
SCHEMBL9531572 0.69 KAT2B (0.58) CNR2CNR1SMN1; SMN2RAB9A

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
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