SCHEMBL5815352

SCHEMBL5815352

O=C(O)C(Cc1cc(Cl)cc(Cl)c1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.45
TPMT P51580 1/20 0.44
LDHA P00338 2/20 0.43
TACR1 P25103 2/20 0.41
GRN P28799 2/20 0.39
SORT1 Q99523 2/20 0.39
PPARG P37231 4/20 0.38
PPARA Q07869 4/20 0.38
FFAR1 O14842 1/20 0.38
KMT2A Q03164 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
SCHEMBL5751477 0.84 MDM2 (0.44) MDM2TPMTLDHATACR1GRN
SCHEMBL1356942 0.81 SLC7A5 (0.57) KMT2A
SCHEMBL1356944 0.81 SLC7A5 (0.57) KMT2A
SCHEMBL5752343 0.79 MDM2 (0.41) MDM2TPMTLDHATACR1GRN
SCHEMBL3470119 0.79 PNMT (0.56) MDM2LDHAPPARGPPARAKMT2A
SCHEMBL1816838 0.78 CYP1A2 (0.42) TPMTPPARG
SCHEMBL1814372 0.78 CYP1A2 (0.42) TPMTPPARG
SCHEMBL6712771 0.77 PPARG (0.59) LDHAPPARGPPARA
SCHEMBL21869317 0.77 GRN (0.46) TACR1GRNSORT1PPARGKMT2A
SCHEMBL29238364 0.77 GRN (0.46) TACR1GRNSORT1PPARGKMT2A

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-2006136327-A1 FUNGICIDAL BENZYLPYRIMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2006-12-28 WO disclosed