SCHEMBL9111302

SCHEMBL9111302

CCCCCC(=O)Nc1ccc(CCCCC[O])cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.63
DGAT2 Q96PD7 1/20 0.63
HPGD P15428 2/20 0.59
POLB P06746 1/20 0.58
THRA P10827 3/20 0.58
THRB P10828 3/20 0.58
S1PR1 P21453 1/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
PSMB11 A5LHX3 1/20 0.56
PSMA7 O14818 1/20 0.56
PSMB1 P20618 1/20 0.56
PSMA1 P25786 1/20 0.56
PSMA2 P25787 1/20 0.56
PSMA3 P25788 1/20 0.56
PSMA4 P25789 1/20 0.56
PSMB8 P28062 1/20 0.56

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
SCHEMBL25269210 0.94 ENPP2 (0.69) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL27909135 0.94 ENPP2 (0.69) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL27663784 0.93 HPGD (0.67) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL7201038 0.89 PSMB11 (0.71) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL8499453 0.88 ENPP2 (0.66) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL26553751 0.87 ENPP2 (0.61) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL26553753 0.87 ENPP2 (0.61) ENPP2DGAT2HPGDPOLBTHRA
Hydrochloric Acid SCHEMBL25402978 0.86 ENPP2 (0.60) ENPP2DGAT2HPGDPOLBTHRA
Hydrochloric Acid SCHEMBL25399235 0.86 ENPP2 (0.60) ENPP2DGAT2HPGDPOLBTHRA
SCHEMBL21998748 0.86 S1PR1 (0.64) ENPP2DGAT2HPGDPOLBTHRA

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-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed