SCHEMBL7202275

SCHEMBL7202275

CCCCCCCCCCCCCC(=O)C(CCl)Cc1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 3/20 0.47
▸ LDHA P00338 1/20 0.47
▸ MMP9 P14780 5/20 0.42
▸ MMP13 P45452 4/20 0.42
▸ MMP2 P08253 3/20 0.42
▸ MMP8 P22894 2/20 0.42
▸ MMP1 P03956 3/20 0.42
▸ ADAM17 P78536 2/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL7202835 0.83 EPHX2 (0.49) KMT2A
SCHEMBL9330077 0.79 CNR1 (0.51) CNR1MMP2
SCHEMBL9236501 0.78 LDHA (0.52) CNR1LDHAMMP9MMP13MMP2
SCHEMBL7205276 0.77 MMP9 (0.53) CNR1LDHAMMP9MMP13MMP2
SCHEMBL28807897 0.77 LDHA (0.58) LDHAMMP9MMP13MMP2MMP1
SCHEMBL28807884 0.77 LDHA (0.58) LDHAMMP9MMP13MMP2MMP1
SCHEMBL28807917 0.77 LDHA (0.58) LDHAMMP9MMP13MMP2MMP1
SCHEMBL25456751 0.77 S1PR1 (0.48) CNR1
SCHEMBL7202278 0.75 EPHX2 (0.46) —
SCHEMBL27707711 0.75 EPHX2 (0.55) CNR1LDHAMMP9MMP13MMP2

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
WO-2003010156-A1 METHOD FOR PREPARING $G(A)-HALOGENOALKYLARYLKETONES AND THEIR HALOGENATED INTERMEDIATE PRODUCTS RHODIA CHIMIE (FR) 2003-02-06 — — WO disclosed
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