SCHEMBL9397268

SCHEMBL9397268

COc1cccc2c1C(=O)C(=O)N(C)C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.55
EGFR P00533 1/20 0.53
PIM1 P11309 1/20 0.53
CASP3 P42574 1/20 0.52
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPT P10636 3/20 0.50
USP2 O75604 2/20 0.50
KDM4E B2RXH2 1/20 0.50
DUSP3 P51452 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TOP1 P11387 1/20 0.50
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
APAF1 O14727 1/20 0.49
MITF O75030 1/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
ELANE P08246 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
SCHEMBL1137970 0.81 TTR (0.47) PRMT1EGFRPIM1MEN1KMT2A
SCHEMBL30067921 0.81 TTR (0.47) PRMT1EGFRPIM1MEN1KMT2A
SCHEMBL3417492 0.79 EGFR (0.76) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL9397152 0.79 CYP1B1 (0.50) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL5816933 0.78 EGFR (0.64) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL8947495 0.77 EGFR (0.73) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL11201120 0.77 KMT2A (0.61) PRMT1EGFRPIM1CASP3MEN1
SCHEMBL3819746 0.77 MEN1 (0.51) PRMT1CASP3MEN1KMT2AALDH1A1
SCHEMBL7792566 0.76 EGFR (0.71) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL2186275 0.76 PRMT1 (0.63) PRMT1MEN1KMT2AALDH1A1MAPT

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
WO-1994027969-A1 ISOQUINOLINETRIONE DERIVATIVES AS HERBICIDES ZENECA LIMITED (GB) 1994-12-08 WO disclosed