SCHEMBL7907620

SCHEMBL7907620

C=C(Cl)C(=O)Nc1ccc2c(C)cc(=O)oc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 4/20 0.69
CA12 O43570 3/20 0.69
CA1 P00915 3/20 0.69
RAB9A P51151 8/20 0.62
NPC1 O15118 8/20 0.62
KDM4E B2RXH2 6/20 0.62
ALDH1A1 P00352 6/20 0.62
HPGD P15428 5/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
HSD17B10 Q99714 2/20 0.62
GAA P10253 2/20 0.60
GLA P06280 1/20 0.60
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
TDP1 Q9NUW8 2/20 0.57
CTDSP1 Q9GZU7 2/20 0.56
MAPT P10636 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CACNA1B Q00975 1/20 0.56
APBA1 Q02410 1/20 0.56

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
SCHEMBL7915781 0.88 CA12 (0.75) CA9CA12CA1RAB9ANPC1
SCHEMBL30862484 0.88 CA12 (0.75) CA9CA12CA1RAB9ANPC1
SCHEMBL11232995 0.85 CA12 (0.74) CA9CA12CA1RAB9ANPC1
SCHEMBL8513693 0.83 CA12 (0.81) CA9CA12CA1RAB9ANPC1
SCHEMBL11230052 0.83 CA12 (0.71) CA9CA12CA1RAB9ANPC1
SCHEMBL8516165 0.82 CA12 (1.00) CA9CA12CA1RAB9ANPC1
SCHEMBL30449676 0.82 CA12 (1.00) CA9CA12CA1RAB9ANPC1
SCHEMBL15747020 0.81 CA12 (0.76) CA9CA12CA1RAB9ANPC1
SCHEMBL22685138 0.81 CA12 (0.76) CA9CA12CA1RAB9ANPC1
SCHEMBL30862483 0.80 CA12 (0.71) CA9CA12CA1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6201087-B1 POLYMERS WHICH CONTAIN COUMARIN OR QUINOLINONE DERIVATIVES AS PHOTOREACTIVE UNITS AS ORIENTING LAYERS FOR LIQUID CRYSTALS; PHOTOCHEMICAL STABILITY AND IMPROVED CONTRAST ROLIC AG (CH) 2001-03-13 US disclosed
EP-0783537-B1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS ROLIC AG (CH) 1999-12-01 EP disclosed