SCHEMBL2809375

SCHEMBL2809375

CCCc1cc(C(=O)O)ccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.48
TSHR P16473 2/20 0.46
RARB P10826 2/20 0.46
KDM4E B2RXH2 2/20 0.44
RXRA P19793 2/20 0.44
RECQL P46063 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
PSMD14 O00487 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
GFER P55789 1/20 0.44
PLEC Q15149 1/20 0.44
ESR1 P03372 2/20 0.42
NSD2 O96028 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL27637429 0.90 MRGPRX4 (0.51) MRGPRX4TSHRKDM4ERXRATDP1
SCHEMBL2807448 0.89 RARB (0.51) MRGPRX4TSHRRARBRXRAALDH1A1
SCHEMBL2808366 0.88 RARB (0.56) TSHRRARBALDH1A1MAPT
SCHEMBL3258577 0.86 ALDH1A1 (0.52) MRGPRX4TSHRKDM4ERXRARECQL
SCHEMBL27906429 0.86 RARB (0.58) TSHRRARBALDH1A1MAPT
SCHEMBL27889921 0.86 RARB (0.58) TSHRRARBALDH1A1MAPT
SCHEMBL27889925 0.86 RARB (0.58) TSHRRARBALDH1A1MAPT
SCHEMBL2811083 0.86 RARB (0.58) TSHRRARBALDH1A1MAPT
SCHEMBL15905718 0.85 EPHX2 (0.50) TSHRRARBKDM4ERXRARECQL
SCHEMBL13943157 0.85 MRGPRX4 (0.43) MRGPRX4TSHRRARBKDM4ERECQL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100068439-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA North aAmerica S.ar.I (US) 2010-03-18 US claimed
WO-2008095071-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA TECHNOLOGIES S.AR.L. (CH) 2008-08-07 WO claimed
EP-3260920-A1 TONER COMPOSITIONS WITH ANTIPLASTICIZERS Xerox Corporation (US) 2017-12-27 EP disclosed
US-9684257-B1 Toner compositions with antiplasticizers XEROX CORPORATION (US) 2017-06-20 US disclosed
US-20100068439-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA North aAmerica S.ar.I (US) 2010-03-18 US disclosed
WO-2008095071-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA TECHNOLOGIES S.AR.L. (CH) 2008-08-07 WO disclosed