SCHEMBL10024009

SCHEMBL10024009

CCc1cc(Cc2ccc(O)cc2)cc(C)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.58
ESR1 P03372 2/20 0.48
ESR2 Q92731 2/20 0.48
HMGB1 P09429 1/20 0.46
CXCL12 P48061 1/20 0.46
PTGS1 P23219 2/20 0.40
PTGS2 P35354 2/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
ALOX5 P09917 1/20 0.40
IDH1 O75874 1/20 0.40
PTPN1 P18031 2/20 0.38
PTPN2 P17706 1/20 0.38
PTPN6 P29350 1/20 0.38
KEAP1 Q14145 1/20 0.38
DHFR P00374 1/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
BACE1 P56817 1/20 0.38
HSPA5 P11021 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
SCHEMBL30375336 0.89 SHBG (0.61) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL13609029 0.89 SHBG (0.61) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL3710965 0.89 SHBG (0.61) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL4063026 0.89 SHBG (0.61) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL69627 0.89 SHBG (0.70) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL30320252 0.86 ESR1 (0.52) SHBGESR1ESR2IDH1PTPN1
SCHEMBL4053628 0.86 ESR1 (0.52) SHBGESR1ESR2IDH1PTPN1
SCHEMBL5527320 0.85 ESR1 (0.61) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL2384360 0.84 SHBG (0.63) SHBGESR1ESR2HMGB1CXCL12
SCHEMBL30003742 0.84 SHBG (0.63) SHBGESR1ESR2HMGB1CXCL12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9120199-B2 Polishing liquid composition KAO CORPORATION (JP) 2015-09-01 US disclosed
US-20120077422-A1 POLISHING LIQUID COMPOSITION KAO CORPORATION (JP) 2012-03-29 US disclosed