SCHEMBL16098684

SCHEMBL16098684

Cc1cc(O)cc2c1c1cc(F)ncc1n2CCN1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CHEK1 O14757 4/20 0.38
WEE1 P30291 4/20 0.38
CNR2 P34972 5/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
CREBBP Q92793 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PDE5A O76074 1/20 0.35
PDE11A Q9HCR9 1/20 0.35
PDE10A Q9Y233 1/20 0.35
CNR1 P21554 2/20 0.35

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
SCHEMBL16099658 0.81 NFATC1 (0.43) MAOAMAOBCHEK1WEE1CDK1
SCHEMBL16093854 0.81 HSD17B10 (0.33) MAOAMAOBMAPTTSHRKDM4E
SCHEMBL16093943 0.77 NFATC1 (0.47) MAOAMAOBCHEK1WEE1KDM4E
SCHEMBL23234240 0.72 ALDH1A1 (0.46) CNR2LMNATSHRKDM4EALDH1A1
SCHEMBL16099619 0.69 MEN1 (0.36) CREBBPKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL16098685 0.68 CHEK1 (0.40) CHEK1WEE1CNR2CDK1CCNB1
SCHEMBL16099686 0.68 NFATC1 (0.41) CHEK1WEE1CNR2CDK1CCNB1
SCHEMBL16099077 0.68 SMN1; SMN2 (0.37) LMNAMAPTTSHRKDM4EALDH1A1
SCHEMBL16123513 0.67 CNR2 (0.41) CNR2LMNAMAPTTSHRCREBBP
SCHEMBL30939870 0.67 CNR2 (0.41) CNR2LMNAMAPTTSHRCREBBP

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-2968284-A2 ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH Osteoqc Inc. (CA) 2016-01-20 EP disclosed
WO-2014153203-A2 ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH OSSIFI INC. (US) 2014-09-25 WO disclosed