SCHEMBL7142672

SCHEMBL7142672

Cc1ccc(-c2cccc(C=O)c2O)cc1.Cc1ccc(-c2cccc(C=O)c2O)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 8/20 0.41
▸ TLR2 O60603 1/20 0.40
▸ TLR1 Q15399 1/20 0.40
▸ TLR6 Q9Y2C9 1/20 0.40
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B1 P14061 1/20 0.35
▸ HSD17B2 P37059 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ PTGS2 P35354 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ AKR1B1 P15121 1/20 0.34

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
SCHEMBL5734028 0.94 ERN1 (0.46) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL3966538 0.89 ERN1 (0.50) ERN1TLR2TLR1TLR6MAOA
SCHEMBL3967846 0.80 ERN1 (0.47) ERN1TLR2TLR1TLR6
SCHEMBL7091474 0.79 CNR2 (0.47) ERN1TLR2TLR1TLR6
SCHEMBL27614250 0.79 ERN1 (0.46) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL29658267 0.79 ERN1 (0.50) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL27595415 0.79 ERN1 (0.50) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL7170981 0.78 PPARG (0.40) ERN1TLR2TLR1TLR6MAOA
SCHEMBL24720517 0.78 TLR8 (0.45) ALDH1A1HSD17B1HSD17B2MCL1PTGS2
SCHEMBL7170990 0.77 MCL1 (0.44) ERN1MCL1PTGS2PTGS1TLR8

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-1244446-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2003-01-08 — — EP disclosed
EP-1244446-A1 THROMBOPOIETIN MIMETICS SmithKline Beecham Corporation (US) 2002-10-02 — — EP disclosed
WO-2001039773-A1 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-06-07 — — WO disclosed
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