SCHEMBL8152954

SCHEMBL8152954

C=C(C)C(=O)OCCC(=Cc1ccc([C@H]2CC[C@H](CCCCC)CC2)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 5/20 0.38
▸ PTGES O14684 3/20 0.38
▸ TSHR P16473 3/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PPARG P37231 2/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ITGB3 P05106 1/20 0.30
▸ ITGA2B P08514 1/20 0.30

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
SCHEMBL8152268 0.99 TSHR (0.39) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8156951 0.99 TSHR (0.39) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8150450 0.97 ALOX5 (0.38) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8158585 0.95 TSHR (0.39) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8157062 0.94 TSHR (0.41) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8143816 0.94 TSHR (0.43) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8150259 0.94 TSHR (0.43) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8153236 0.93 CYP2C9 (0.44) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8150628 0.89 CA1 (0.33) ALOX5PTGESTSHRCYP2C9MAPT
SCHEMBL8143521 0.85 ESR2 (0.36) ALOX5TSHRALDH1A1RAB9APOLB

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-RE36625-E Linear and cyclic polymers or oligomers having a photoreactive ethene group ROLIC AG (CH) 2000-03-21 — — US disclosed
US-5539074-A LIQUID CRYSTAL POLYMERS ON SILICA FOR LIGHT SENSITIVE ELEMENTS HOFFMANN-LA ROCHE INC. (US) 1996-07-23 — — US disclosed
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