SCHEMBL10603403

SCHEMBL10603403

CCCCCC(O)/C=C/C1C=C(Cl)C(=O)/C1=C\CCCCCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 3/20 0.50
▸ TRPA1 O75762 2/20 0.50
▸ PPARG P37231 2/20 0.48
▸ GPR132 Q9UNW8 1/20 0.48
▸ PTGER4 P35408 5/20 0.46
▸ PTGER3 P43115 3/20 0.46
▸ PTGER2 P43116 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ABCC3 O15438 1/20 0.46
▸ ABCC4 O15439 1/20 0.46
▸ RARB P10826 1/20 0.46
▸ RARG P13631 1/20 0.46
▸ DRD1 P21728 1/20 0.46
▸ PTGIR P43119 1/20 0.46
▸ LMNA P02545 1/20 0.46

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
SCHEMBL10603408 1.00 NR4A2 (0.50) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10608251 0.94 TRPA1 (0.40) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10608248 0.94 TRPA1 (0.40) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10605176 0.90 TRPA1 (0.38) NR4A2TRPA1PPARGGPR132MEN1
SCHEMBL10605177 0.90 TRPA1 (0.38) NR4A2TRPA1PPARGGPR132MEN1
SCHEMBL10603560 0.89 NR4A2 (0.39) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10603544 0.88 PTGIR (0.47) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10603539 0.88 PTGIR (0.47) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10605122 0.88 NR4A2 (0.39) NR4A2TRPA1PPARGGPR132PTGER4
SCHEMBL10605252 0.88 TRPA1 (0.39) NR4A2TRPA1PTGER4PTGER3PTGER2

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
EP-0131441-B1 5-ALKYLIDENE-2-HALO-4-SUBSTITUTED-2-CYCLOPENTENONE AND PROCESS FOR PRODUCTION THEREOF TEIJIN LIMITED (JP) 1989-10-18 — — EP disclosed
US-4689426-A ANTITUMOR AGENTS, VIRCIDES, BACTERICIDES TEIJIN LIMITED (JP) 1987-08-25 — — US disclosed
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