SCHEMBL9382136

SCHEMBL9382136

C=CCn1c2ccccc2c2c(N)c3c(nc21)CCCC3=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
GAA P10253 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 2/20 0.38
TSHR P16473 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.37
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.36
HSP90AA1 P07900 1/20 0.36
TLR9 Q9NR96 1/20 0.36
PLK1 P53350 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 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
SCHEMBL9381638 0.86 GABRP (0.49) KDM4EGAAKMT2AALDH1A1MAPT
SCHEMBL9386680 0.84 KDM4E (0.47) KDM4EGAAKMT2AALDH1A1MAPT
SCHEMBL9381680 0.80 KDM4E (0.48) KDM4EKMT2AMEN1RXFP1HSD17B10
SCHEMBL9381579 0.78 P2RX4 (0.49) KDM4EGAAKMT2AMEN1RXFP1
SCHEMBL9690959 0.70 GABRP (0.59) GAAKMT2AMEN1RXFP1HSD17B10
SCHEMBL9690819 0.69 GABRP (0.53) KDM4EGAAKMT2AMEN1RXFP1
SCHEMBL4495989 0.67 KDM4E (0.82) KDM4EGAAALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL8984092 0.66 KDM4E (0.80) KDM4EGAAKMT2AALDH1A1MAPT
SCHEMBL9062156 0.66 ALDH1A1 (0.46) KDM4EGAAKMT2AMEN1RXFP1
SCHEMBL9382438 0.65 KDM4E (0.50) KDM4EKMT2AMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372962-B1 Quinindolinone derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1994-07-20 EP claimed
EP-0372962-A2 Quinindolinone derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-06-13 EP claimed
EP-0372962-B1 Quinindolinone derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1994-07-20 EP disclosed
US-5079246-A Antidepressants, anxiolytic agents BEACHAM GROUP P. L. C. (GB) 1992-01-07 US disclosed
EP-0372962-A2 Quinindolinone derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-06-13 EP disclosed