SCHEMBL7053346

SCHEMBL7053346

CC(C)(C)C=C(C=CC(=O)O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
EGLN3 Q9H6Z9 1/20 0.43
HCAR2 Q8TDS4 7/20 0.37
ALDH1A1 P00352 3/20 0.37
ALOX15 P16050 2/20 0.37
RECQL P46063 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRIK1 P39086 1/20 0.34
GAA P10253 1/20 0.32
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 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
SCHEMBL4866299 0.79 TET2 (0.31)
SCHEMBL1504595 0.76 TSHR (0.38) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL1504598 0.76 TSHR (0.38) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL1504597 0.76 TSHR (0.38) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL9311666 0.74 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL8031031 0.73 LMNA (0.36) ALDH1A1GRIK1
Maleic Acid SCHEMBL9805234 0.69 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL9805248 0.69 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL2721423 0.69 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL21775463 0.69 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2

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
WO-2003021357-A1 FREE-ACID CONTAINING POLYMERS AND THEIR USE IN PHOTORESISTS ARCH SPECIALTY CHEMICALS, INC. (US) 2003-03-13 WO disclosed
EP-0877591-B1 HAIR CONDITIONING COMPOSITIONS PROCTER & GAMBLE (US) 2002-09-18 EP disclosed