SCHEMBL8152268

SCHEMBL8152268

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

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.39
▸ ALOX5 P09917 4/20 0.37
▸ PTGES O14684 2/20 0.37
▸ CYP2C9 P11712 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ SPHK1 Q9NYA1 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ DGAT1 O75907 1/20 0.31

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
SCHEMBL8156951 1.00 TSHR (0.39) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8152954 0.99 ALOX5 (0.38) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8150450 0.96 ALOX5 (0.38) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8143816 0.95 TSHR (0.43) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8150259 0.95 TSHR (0.43) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8158585 0.94 TSHR (0.39) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8157062 0.94 TSHR (0.41) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8153236 0.92 CYP2C9 (0.44) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8150628 0.88 CA1 (0.33) TSHRALOX5PTGESCYP2C9MAPT
SCHEMBL8143521 0.84 ESR2 (0.36) TSHRALOX5ALDH1A1TDP1RAB9A

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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