SCHEMBL7940157

SCHEMBL7940157

COc1ccc(OC)c2c1C(=O)N(C)C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.50
MAPT P10636 4/20 0.50
MAPK1 P28482 2/20 0.50
RAB9A P51151 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
S1PR4 O95977 1/20 0.50
HSP90AA1 P07900 1/20 0.50
G6PD P11413 1/20 0.50
S1PR1 P21453 1/20 0.50
OPRK1 P41145 1/20 0.50
HTT P42858 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
MCL1 Q07820 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
TLR9 Q9NR96 1/20 0.50
PRMT1 Q99873 1/20 0.50
ALDH1A1 P00352 6/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48

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
SCHEMBL3286114 0.79 CA1 (0.52) KDM4EMAPTMAPK1RAB9ANPSR1
SCHEMBL10666403 0.74 PRMT1 (0.49) KDM4EMAPTMAPK1RAB9ANPSR1
SCHEMBL11040911 0.74 PRMT1 (0.67) KDM4EMAPTHTTPRMT1ALDH1A1
SCHEMBL11134106 0.74 MAPT (0.73) KDM4EMAPTMAPK1RAB9ANPSR1
SCHEMBL9397268 0.73 PRMT1 (0.55) KDM4EMAPTRAB9AHTTPRMT1
SCHEMBL25019712 0.71 MEN1 (0.52) KDM4EMAPTMAPK1PRMT1ALDH1A1
SCHEMBL2005311 0.70 PRMT1 (0.53) KDM4EMAPTHTTPRMT1ALDH1A1
SCHEMBL1137970 0.70 TTR (0.47) KDM4EMAPTMAPK1RAB9ANPSR1
SCHEMBL30067921 0.70 TTR (0.47) KDM4EMAPTMAPK1RAB9ANPSR1
SCHEMBL358094 0.70 TOP1 (0.63) KDM4EMAPTMAPK1RAB9ANPSR1

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-6191307-B1 Process for making benzoic acids ALBEMARLE CORPORATION 2001-02-20 US disclosed