SCHEMBL9373300

SCHEMBL9373300

CCCCCN1CCC(=O)c2ccc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
GRM5 P41594 1/20 0.39
HSP90AA1 P07900 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRA6 Q16445 1/20 0.38
CYP1A1 P04798 2/20 0.38
CNR2 P34972 1/20 0.38
CRHR1 P34998 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
SRD5A1 P18405 1/20 0.36

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
SCHEMBL6760699 0.80 ALDH1A1 (0.50) KDM4EGAAGRM5ALDH1A1MAPT
SCHEMBL11206551 0.77 CRHR1 (0.49) KDM4EGAACRHR1HTR2AHTR2C
SCHEMBL28477745 0.75 ALDH1A1 (0.38) HTR2AHTR2CHTR2BALDH1A1SRD5A1
SCHEMBL30678350 0.75 ALDH1A1 (0.38) HTR2AHTR2CHTR2BALDH1A1SRD5A1
SCHEMBL10493799 0.74 P2RX7 (0.47) KDM4EGAAALDH1A1MAPTLMNA
SCHEMBL11144623 0.73 HDAC2 (0.42) KDM4EGAAGABRA1GABRG2GABRB3
SCHEMBL9482548 0.72 KDM4E (0.42) KDM4EGAAGABRA1GABRG2GABRB3
SCHEMBL14746122 0.71 NOTUM (0.42) KDM4EGAAALDH1A1MAPTSRD5A1
SCHEMBL4597640 0.70 ALDH1A1 (0.64) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1725665 0.69 ALDH1A1 (0.43) KDM4EGAAGRM5ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0315115-B1 1-acyl-2,3-dihydro-4(1H)-quinolinone-4-oxime derivatives, process for producing them and use thereof MOCHIDA PHARM CO LTD (JP) 1994-06-15 EP disclosed
US-4968680-A HYPOTENSIVE, ANTIEDEMIC, DIURETIC MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1990-11-06 US disclosed
EP-0315115-A2 1-acyl-2,3-dihydro-4(1H)-quinolinone-4-oxime derivatives, process for producing them and use thereof MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1989-05-10 EP disclosed