SCHEMBL8704371

SCHEMBL8704371

NC1C=C(c2ccccc2)C=CC1=O

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
MAPT P10636 1/20 0.33
MAOB P27338 2/20 0.31
NOTUM Q6P988 1/20 0.31
MAOA P21397 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM1A O60341 2/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31
CFTR P13569 1/20 0.30
GOPC Q9HD26 1/20 0.30
KDM4E B2RXH2 1/20 0.30
PLA2G10 O15496 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL8710011 1.00 LMNA (0.33) LMNAHTTMAPTMAOBNOTUM
SCHEMBL3000591 0.72 BRD4 (0.41) HTTMAOBMAOAALDH1A1
SCHEMBL28922481 0.64
SCHEMBL24426420 0.64 KDM1A (0.34) LMNAHTTMAPTMAOBMAOA
SCHEMBL15810954 0.64 HTT (0.31) HTTMAOBALDH1A1KDM1A
SCHEMBL17382164 0.63 ALDH1A1 (0.44) LMNAMAOBMAOAALDH1A1KDM1A
SCHEMBL24355003 0.63 HTT (0.36) HTTMAPTALDH1A1HSD17B10
SCHEMBL8738128 0.61 MAPT (0.54) LMNAMAPTMAOBMAOAALDH1A1
SCHEMBL18887607 0.61 MAOA (0.50) LMNAHTTMAPTMAOBMAOA
SCHEMBL27549602 0.60 ALDH1A1 (0.35) HTTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5795887-A Method of inducing cholecystokinin agonist activity using 1,4- Benzodiazepine compounds GLAXO WELLCOME INC. (US) 1998-08-18 US disclosed