SCHEMBL8445200

SCHEMBL8445200

O=c1ccc2ccccc2n1CCN1CCCCC1CC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 1/20 0.37
SCN7A Q01118 2/20 0.36
ADRA2A P08913 1/20 0.36
CA12 O43570 1/20 0.35
BRD4 O60885 1/20 0.35
BRPF1 P55201 1/20 0.35
CA9 Q16790 1/20 0.35
KAT2B Q92831 1/20 0.35
BRD9 Q9H8M2 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
HTR6 P50406 4/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 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
SCHEMBL8442954 0.93 DRD2 (0.36) KDM4EALDH1A1NPSR1HSD17B10HPGD
SCHEMBL8445201 0.86 IDE (0.46) KDM4EALDH1A1NPSR1HSD17B10HPGD
SCHEMBL8445196 0.82 SCN7A (0.43) KDM4EALDH1A1NPSR1HSD17B10HPGD
SCHEMBL8442413 0.80 APAF1 (0.45) NPSR1HPGD
SCHEMBL8443523 0.80 APAF1 (0.45) NPSR1HPGDCNR2
SCHEMBL8442952 0.78 TMEM97 (0.44)
SCHEMBL8445198 0.77 OPRM1 (0.47) KDM4EALDH1A1NPSR1HSD17B10SCN7A
SCHEMBL31033172 0.76 SCN7A (0.56) KDM4EALDH1A1SCN7ACA12BRD4
SCHEMBL28404370 0.76 KDM4E (0.59) KDM4EALDH1A1NPSR1HSD17B10HPGD
SCHEMBL8443521 0.73 DRD2 (0.48)

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-0934932-A1 QUINOLINE DERIVATIVES AND PSYCHOTROPIC AGENT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-08-11 EP claimed
EP-0934932-A1 QUINOLINE DERIVATIVES AND PSYCHOTROPIC AGENT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-08-11 EP disclosed