SCHEMBL4640924

SCHEMBL4640924

C=Cc1ccc(OC)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.56
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 6/20 0.42
TSHR P16473 1/20 0.42
SRC P12931 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 2/20 0.40
ALOX15 P16050 1/20 0.40
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTT P42858 1/20 0.40
GAA P10253 2/20 0.39
NPC1 O15118 1/20 0.39
TUBB4A P04350 2/20 0.39
TUBB P07437 2/20 0.39

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
SCHEMBL16954405 0.84 TRPA1 (0.61) TRPA1KMT2AMEN1ALDH1A1TSHR
SCHEMBL27476042 0.82 KMT2A (0.48) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL29778007 0.81 TRPA1 (0.68) TRPA1ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL33786 0.81 TRPA1 (0.68) TRPA1ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL2094496 0.81 CYP1A1 (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL2094493 0.81 CYP1A1 (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL4640917 0.80 KMT2A (0.50) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL335717 0.80 ALDH1A1 (0.68) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL29952908 0.80 ALDH1A1 (0.68) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL11001934 0.80 KMT2A (0.47) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020066851-A1 ACRYLIC COATING COMPOSITION CONTAINING INORGANIC OXIDE PARTICLES 日産化学株式会社 2020-04-02 WO disclosed
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
WO-2008141119-A2 MODULATORS OF CFTR VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-11-20 WO disclosed
EP-1630606-B1 POSITIVE PHOTOSENSITIVE COMPOSITION THINK LABS KK (JP) 2008-08-13 EP disclosed
US-20070212640-A1 Positive Photosensitive Composition THINK LABORATORY CO., LTD. (JP) 2007-09-13 US disclosed
EP-1775632-A1 POSITIVE-WORKING PHOTOSENSITIVE COMPOSITION THINK LABORATORY CO., LTD. (JP) 2007-04-18 EP disclosed
US-20060222998-A1 Positive photosensitive composition THINK LABORATORY CO., LTD. (JP) 2006-10-05 US disclosed
EP-1630606-A1 POSITIVE PHOTOSENSITIVE COMPOSITION THINK LABORATORY CO., LTD. (JP) 2006-03-01 EP disclosed