SCHEMBL13855434

SCHEMBL13855434

Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(C)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2C)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
TSHR P16473 2/20 0.42
CASP1 P29466 2/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 2/20 0.42
CASP7 P55210 1/20 0.42
CA9 Q16790 6/20 0.41
CA12 O43570 4/20 0.41
CA1 P00915 4/20 0.41
CA2 P00918 2/20 0.41
APP P05067 1/20 0.39
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
CYP1A2 P05177 1/20 0.37
GRM1 Q13255 1/20 0.37

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
SCHEMBL9927356 0.92 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL19399219 0.92 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL12260131 0.90 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL1960350 0.89 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL13522416 0.87 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL12171649 0.87 ALDH1A1 (0.45) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL4549128 0.86 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL1960124 0.86 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL19628661 0.86 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL818923 0.86 MAPK1 (0.49) ALDH1A1MEN1KMT2ACASP1NPSR1

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
US-20180028984-A1 POLYIMIDE MIXTURE AND GAS SEPARATION MEMBRANE TAIWAN TEXTILE RESEARCH INSTITUTE (TW) 2018-02-01 US disclosed
US-20090136689-A1 LIQUID CRYSTAL DISPLAY DEVICE LEU CHYI-MING 2009-05-28 US disclosed
US-20070065603-A1 Liquid crystal display device INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2007-03-22 US disclosed