SCHEMBL11333346

SCHEMBL11333346

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 10/20 0.45
TSHR P16473 4/20 0.36
TP53 P04637 2/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
LMNA P02545 1/20 0.35
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
ALOX15 P16050 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 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
SCHEMBL11333320 1.00 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL11333311 0.92 HCAR2 (0.36) HCAR2TSHRTP53ALDH1A1KEAP1
SCHEMBL8405431 0.88 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7162573 0.88 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7167884 0.88 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7162567 0.88 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL8405432 0.88 HCAR2 (0.45) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL8965554 0.85 TSHR (0.39) TSHRTP53LMNAALDH1A1HSD17B10
SCHEMBL9862055 0.83 TSHR (0.35) TSHRTP53LMNAALDH1A1HSD17B10
Maleic Acid SCHEMBL17821261 0.82 HCAR2 (0.41) HCAR2TSHRTP53EGLN1EGLN3

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-4275142-A CONJUGATED DIOLEFIN-ACRYLIC ACID OR ANHYDRIDE COPOLYMER, PHOTOSENSITIZER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1981-06-23 US claimed
US-4275142-A CONJUGATED DIOLEFIN-ACRYLIC ACID OR ANHYDRIDE COPOLYMER, PHOTOSENSITIZER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1981-06-23 US disclosed