SCHEMBL11830550

SCHEMBL11830550

CC(=O)c1cc(CCC(Cl)C(=O)O)ccc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.46
▸ LTB4R Q15722 1/20 0.42
▸ LTB4R2 Q9NPC1 1/20 0.42
▸ MMP12 P39900 3/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ PTPN1 P18031 4/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ MMP14 P50281 1/20 0.37
▸ PTPN2 P17706 1/20 0.37
▸ PTPN6 P29350 1/20 0.37
▸ MME P08473 1/20 0.36
▸ FNTA P49354 1/20 0.36
▸ FNTB P49356 1/20 0.36
▸ PGGT1B P53609 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ BRS3 P32247 1/20 0.36
▸ RXRA P19793 1/20 0.36

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
SCHEMBL11827837 0.84 PPARG (0.49) KMT2AMMP2MMP9MMP13MMP14
SCHEMBL10449003 0.84 FOLH1 (0.48) FOLH1LTB4RLTB4R2MMP12PTPN1
SCHEMBL11837086 0.83 BACE1 (0.44) FOLH1MMP12KMT2APTPN1MMP2
SCHEMBL11823054 0.82 CSNK2A1 (0.53) FOLH1MMP12KMT2AMMP2MMP9
SCHEMBL11832248 0.81 KMT2A (0.39) FOLH1MMP12KMT2AMMP2MMP9
SCHEMBL11821466 0.81 CD274 (0.39) FOLH1MMP12KMT2APTPN1MMP2
SCHEMBL11828303 0.81 ADAMTS4 (0.41) FOLH1MMP12KMT2AMMP2MMP9
SCHEMBL11829226 0.81 FOLH1 (0.41) FOLH1MMP12KMT2AMMP2MMP9
SCHEMBL11837826 0.81 PTGS1 (0.49) KMT2AMMP2MEN1FABP2TSHR
SCHEMBL11835902 0.81 BACE1 (0.44) MMP12KMT2APPARGPPARAPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 — — US disclosed
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