SCHEMBL11035914

SCHEMBL11035914

CCCCCCCCC(C)c1ccccc1O.CCCCCCCCc1ccccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.51
▸ CYSLTR2 Q9NS75 7/20 0.48
▸ CYSLTR1 Q9Y271 7/20 0.48
▸ BID P55957 3/20 0.47
▸ MCL1 Q07820 3/20 0.47
▸ BCL2L1 Q07817 2/20 0.47
▸ BAK1 Q16611 2/20 0.47
▸ KAT8 Q9H7Z6 2/20 0.47
▸ PPARG P37231 1/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ EP300 Q09472 1/20 0.47
▸ KAT2A Q92830 1/20 0.47
▸ KAT2B Q92831 1/20 0.47
▸ KAT5 Q92993 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47
▸ LIPG Q9Y5X9 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ ALOX5 P09917 1/20 0.45

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
SCHEMBL9804614 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL11779391 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL983826 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL984105 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL4942228 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL983629 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL982149 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL1837139 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL10894979 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1
SCHEMBL789269 0.89 TSHR (0.63) TSHRCYSLTR2CYSLTR1PPARGMEN1

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
EP-0130584-A2 Improved polyurethane binder compositions ACME RESIN CORPORATION (US) 1985-01-09 — — EP disclosed
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