SCHEMBL14144968

SCHEMBL14144968

Cc1cc(-c2cc(=O)c3c(O)cc(S)cc3o2)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLH Q9Y253 5/20 0.58
▸ CYP1B1 Q16678 5/20 0.58
▸ IP6K2 Q9UHH9 5/20 0.58
▸ MEN1 O00255 4/20 0.58
▸ MAPT P10636 4/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ CYP1A1 P04798 4/20 0.58
▸ CYP1A2 P05177 4/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ KDM4E B2RXH2 3/20 0.58
▸ CYP3A4 P08684 3/20 0.58
▸ CYP2C9 P11712 3/20 0.58
▸ ALOX15 P16050 3/20 0.58
▸ CYP2C19 P33261 3/20 0.58
▸ HSD17B10 Q99714 3/20 0.58
▸ CYP19A1 P11511 3/20 0.58
▸ MAOB P27338 3/20 0.58
▸ FLT3 P36888 3/20 0.58
▸ MKNK2 Q9HBH9 3/20 0.58
▸ CSNK2A2 P19784 3/20 0.58

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
SCHEMBL13237064 0.88 POLH (0.74) POLHCYP1B1IP6K2MEN1MAPT
SCHEMBL13300950 0.86 CYP1B1 (0.77) POLHCYP1B1IP6K2MEN1MAPT
SCHEMBL13237123 0.83 KMT2A (0.76) POLHCYP1B1IP6K2MEN1MAPT
SCHEMBL14145325 0.82 CYP3A4 (0.76) POLHCYP1B1IP6K2MEN1MAPT
SCHEMBL10026574 0.77 POLH (0.74) POLHCYP1B1IP6K2MEN1MAPT
SCHEMBL13955211 0.76 TP53 (0.57) MAPTCYP3A4CSNK2A2CSNK2BCSNK2A1
SCHEMBL11981018 0.76 CYP1B1 (0.77) POLHCYP1B1IP6K2MEN1MAPT
Luteolin SCHEMBL28336941 0.74 POLH (0.94) POLHCYP1B1IP6K2MEN1MAPT
Luteolin SCHEMBL20426 0.73 POLH (1.00) POLHCYP1B1IP6K2MEN1MAPT
Luteolin SCHEMBL30045580 0.73 POLH (1.00) POLHCYP1B1IP6K2MEN1MAPT

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-2008083332-A1 ANALGESIC AND ANTI-INFLAMMATORY COMPOSITIONS AND METHODS WITH FLAVONOID GLYCOSIDE -TYPE COMPOUNDS BMB PATENT HOLDING CORPORATION (US) 2008-07-10 — — WO disclosed
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