SCHEMBL11248192

SCHEMBL11248192

CCOC(=O)C1(F)C(=O)NC(=O)NC1Sc1ccc2ccccc2c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.38
GAA P10253 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HCRTR1 O43613 1/20 0.35
CNR2 P34972 1/20 0.34
NFKB1 P19838 2/20 0.34
NFKB2 Q00653 2/20 0.34
RELA Q04206 2/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL11249308 0.88 POLB (0.41) GAAALDH1A1MEN1KMT2ACYP1A2
SCHEMBL11236106 0.79 LMNA (0.41) GAAALDH1A1MEN1KMT2ACYP1A2
SCHEMBL11241152 0.78 ALDH1A1 (0.38) GAAALDH1A1MEN1KMT2APOLB
SCHEMBL11243909 0.76 USP2 (0.35) GAAALDH1A1MEN1KMT2ACYP1A2
SCHEMBL11240689 0.73 ALDH1A1 (0.37) GAAALDH1A1MEN1KMT2APOLB
SCHEMBL11248698 0.73 ALDH1A1 (0.35) ALDH1A1MEN1KMT2APOLBTSHR
SCHEMBL11235754 0.73 MEN1 (0.40) OPRM1GAAALDH1A1MEN1KMT2A
SCHEMBL11246583 0.72 HSD17B10 (0.36) ALDH1A1MEN1KMT2APOLBTSHR
SCHEMBL11243202 0.72 HSD17B10 (0.36) ALDH1A1MEN1KMT2APOLBTSHR
SCHEMBL11237613 0.70 POLB (0.35) GAAALDH1A1MEN1KMT2APOLB

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-4329460-A ANTICANCER AGENTS, ANTIVIRAL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-05-11 US claimed