SCHEMBL8577393

SCHEMBL8577393

CC1(C)Oc2ccccc2C(=O)N1CCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HEXA P06865 1/20 0.36
HEXB P07686 1/20 0.36
POLB P06746 2/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 3/20 0.35
MDM2 Q00987 2/20 0.35
HPGD P15428 1/20 0.35
GLA P06280 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL14431713 0.77 CNR1 (0.48) NPSR1HTTALDH1A1MEN1KMT2A
SCHEMBL8576743 0.74 ALDH1A1 (0.46) NPSR1HTTALDH1A1MEN1KMT2A
SCHEMBL8796992 0.73 HPGD (0.42) NPSR1ALDH1A1SMN1; SMN2POLBRAB9A
SCHEMBL11376573 0.73 ALDH1A1 (0.51) NPSR1HTTALDH1A1MEN1KMT2A
SCHEMBL8624518 0.72 CES1 (0.43) NPSR1HTTALDH1A1SMN1; SMN2RAB9A
SCHEMBL8578690 0.71 MAOA (0.38) HTTALDH1A1MEN1KMT2AMAPT
SCHEMBL8578688 0.70 HTT (0.32) NPSR1HTT
SCHEMBL28631453 0.67 HEXA (0.40) NPSR1ALDH1A1MEN1CYP1A2CYP2D6
SCHEMBL8576377 0.67 KDM4E (0.40) ALDH1A1KMT2AHEXAHEXBRAB9A
SCHEMBL11403812 0.66 POLB (0.52) NPSR1ALDH1A1MEN1CYP1A2KMT2A

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
US-5710152-A ANTIDIABETIC, ANTILIPEMIC, AND HYPOGLYCEMIC AGENTS; DIETETICS SS PHARMACEUTICAL CO., LTD. (JP) 1998-01-20 US disclosed
EP-0787727-A1 Benzoazine derivative or salt thereof and pharmaceutical composition comprising the same SS Pharmaceutical Co., Ltd. (JP) 1997-08-06 EP disclosed