SCHEMBL10603475

SCHEMBL10603475

CCCCCCC=CC1C=CC(=O)C1=CCCCCCC(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ EPHX2 P34913 2/20 0.45
▸ ALOX5 P09917 3/20 0.42
▸ ABHD16A O95870 1/20 0.42
▸ OXER1 Q8TDS5 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ TRPA1 O75762 1/20 0.42
▸ MIF P14174 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ POLM Q9NP87 1/20 0.42
▸ POLK Q9UBT6 1/20 0.42
▸ POLL Q9UGP5 1/20 0.42
▸ POLH Q9Y253 1/20 0.42

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
SCHEMBL10608167 1.00 NFKB1 (0.49) NFKB1NFKB2RELAEPHX2ALOX5
SCHEMBL10603470 1.00 NFKB1 (0.49) NFKB1NFKB2RELAEPHX2ALOX5
SCHEMBL10772968 1.00 NFKB1 (0.49) NFKB1NFKB2RELAEPHX2ALOX5
SCHEMBL10608164 1.00 NFKB1 (0.49) NFKB1NFKB2RELAEPHX2ALOX5
SCHEMBL10772965 1.00 NFKB1 (0.49) NFKB1NFKB2RELAEPHX2ALOX5
SCHEMBL30183086 0.87 PTGER3 (0.46) NFKB1NFKB2RELAABHD16AMAPT
SCHEMBL10622161 0.87 PPARG (0.55) NFKB1NFKB2RELAOXER1MAPT
SCHEMBL10622158 0.87 PPARG (0.55) NFKB1NFKB2RELAOXER1MAPT
SCHEMBL10605434 0.86 NFKB1 (0.46) NFKB1NFKB2RELAEPHX2ABHD16A
SCHEMBL10772972 0.86 NFKB1 (0.46) NFKB1NFKB2RELAEPHX2ABHD16A

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 6 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-4766147-A ANTITUMOR AGENTS TEIJIN LIMITED (JP) 1988-08-23 — — US disclosed
EP-0106576-B1 NOVEL 5-MEMBERED CYCLIC COMPOUNDS, PROCESS FOR THE PRODUCTION THEREOF, AND PHARMACEUTICAL USE THEREOF TEIJIN LIMITED (JP) 1988-03-09 — — EP disclosed
US-4689426-A ANTITUMOR AGENTS, VIRCIDES, BACTERICIDES TEIJIN LIMITED (JP) 1987-08-25 — — US disclosed
EP-0131441-A2 5-Alkylidene-2-halo-4-substituted-2-cyclopentenone and process for production thereof TEIJIN LIMITED (JP) 1985-01-16 — — EP disclosed
EP-0106576-A2 Novel 5-membered cyclic compounds, process for the production thereof, and pharmaceutical use thereof TEIJIN LIMITED (JP) 1984-04-25 — — EP disclosed
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