SCHEMBL17074610

SCHEMBL17074610

CCCNc1cnn(Cc2ccccc2)c(=O)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.57
▸ KDM4E B2RXH2 3/20 0.57
▸ RAB9A P51151 3/20 0.57
▸ BRD4 O60885 4/20 0.55
▸ BRD9 Q9H8M2 3/20 0.55
▸ KAT2B Q92831 2/20 0.55
▸ ALDH1A1 P00352 5/20 0.53
▸ MAPT P10636 1/20 0.53
▸ CNR2 P34972 4/20 0.52
▸ CNR1 P21554 1/20 0.49
▸ BPTF Q12830 3/20 0.48
▸ HTT P42858 5/20 0.48
▸ NPSR1 Q6W5P4 4/20 0.48
▸ LMNA P02545 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ NPBWR1 P48145 1/20 0.46
▸ PKM P14618 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.45

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
SCHEMBL17074602 0.80 RAB9A (0.85) SMN1; SMN2KDM4ERAB9ABRD4BRD9
SCHEMBL11004228 0.79 BRD4 (0.56) SMN1; SMN2KDM4ERAB9ABRD4BRD9
SCHEMBL17074604 0.78 CNR2 (0.54) SMN1; SMN2KDM4ERAB9ABRD4BRD9
SCHEMBL18454995 0.76 HTT (0.59) SMN1; SMN2KDM4ERAB9ABRD4ALDH1A1
SCHEMBL1691901 0.75 HTT (0.71) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT
SCHEMBL27077676 0.73 KMT2A (0.50) SMN1; SMN2KDM4ERAB9ABRD4BRD9
SCHEMBL8963991 0.73 HTT (0.59) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT
SCHEMBL22989953 0.73 ALDH1A1 (0.52) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT
SCHEMBL4799238 0.73 ALDH1A1 (0.52) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT
SCHEMBL9239743 0.73 HTT (0.52) SMN1; SMN2KDM4ERAB9AALDH1A1MAPT

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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