SCHEMBL7792476

SCHEMBL7792476

CCc1cc(C(=O)O)cc(C(C)(C)C)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 2/20 0.46
TPMT P51580 5/20 0.42
RARA P10276 2/20 0.41
RARB P10826 2/20 0.41
RARG P13631 2/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
PKM P14618 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
PTGS2 P35354 1/20 0.38

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
SCHEMBL7792498 0.88 TPMT (0.43) TNFRSF1ATPMTRARARARBRARG
SCHEMBL3637333 0.86 TNFRSF1A (0.56) TNFRSF1ATPMTRARARARBRARG
SCHEMBL7796420 0.85 TPMT (0.39) TNFRSF1ATPMTRARARARBRARG
SCHEMBL1573216 0.84 TPMT (0.52) TPMTCA12CA1CA2CA3
SCHEMBL7796475 0.83 TNFRSF1A (0.48) TNFRSF1ATPMTRARARARBRARG
SCHEMBL7796424 0.82 PLA2G2A (0.40) TNFRSF1ATPMTTSHR
SCHEMBL7792403 0.80 TNFRSF1A (0.48) TNFRSF1ATPMTRARARARBRARG
SCHEMBL7933935 0.80 SLC29A1 (0.39) TNFRSF1APKMLMNAALDH1A1TSHR
SCHEMBL7786480 0.78 NR1H4 (0.44) TNFRSF1ANR1H4ALDH1A1TSHR
SCHEMBL7786607 0.78 TNFRSF1A (0.47) TNFRSF1ATPMTRARARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed