SCHEMBL6151978

SCHEMBL6151978

Cc1cccc(C(=O)O)c1Oc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
KDM4E B2RXH2 2/20 0.62
HPGD P15428 2/20 0.62
HSD17B10 Q99714 2/20 0.62
MYC P01106 1/20 0.51
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.48
LPAR1 Q92633 2/20 0.48
GAA P10253 1/20 0.48
CRHBP P24387 1/20 0.48
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
CRHR2 Q13324 1/20 0.48
LPAR5 Q9H1C0 1/20 0.48
AKR1C3 P42330 2/20 0.46
MEN1 O00255 1/20 0.46
AKR1B10 O60218 1/20 0.46
TRPA1 O75762 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
SCHEMBL27974766 0.87 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL11138432 0.87 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL8031428 0.87 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDHSD17B10AKR1C3
SCHEMBL8954611 0.86 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL27852470 0.85 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL4955520 0.85 TDP1 (0.54) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL27315699 0.84 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL20346750 0.84 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL8782258 0.83 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL972675 0.83 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10MYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1587091-A1 INFORMATION RECORDING MEDIUM Mitsubishi Chemical Corporation (JP) 2005-10-19 EP disclosed
US-20050036768-A1 Information recording medium MITSUBISHI CHEMICAL CORPORATION (JP) 2005-02-17 US disclosed
CN-1460097-A NF-kB inhibitor containing substituted benzoic acid derivative as active ingredient DAIICHI SUNTORY SEIYAKU CO LTD (JP) 2003-12-03 CN disclosed