SCHEMBL28073169

SCHEMBL28073169

CC=CC(=O)OCc1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
HCAR2 Q8TDS4 1/20 0.45
FOLH1 Q04609 3/20 0.44
LMNA P02545 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 3/20 0.41
GSTP1 P09211 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C9 P11712 1/20 0.40
HIF1A Q16665 1/20 0.40
CA12 O43570 1/20 0.40
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40

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
SCHEMBL27750212 0.86 LMNA (0.51) TP53HTTHCAR2FOLH1LMNA
SCHEMBL21049233 0.84 HSD17B10 (0.45) TP53HCAR2LMNAKDM4EMAPT
SCHEMBL14937097 0.81 MAOB (0.45) HCAR2LMNAKDM4EMAPTALDH1A1
SCHEMBL29445300 0.81 TP53 (0.49) TP53HTTHCAR2FOLH1MRGPRX4
SCHEMBL14937098 0.81 MAOB (0.45) HCAR2LMNAKDM4EMAPTALDH1A1
SCHEMBL5176891 0.81 IDO1 (0.46) HCAR2LMNAGSTP1CA12AKR1B10
Benzoic Acid SCHEMBL28243751 0.80 HCAR2 (0.41) HCAR2LMNAMAPTGSTP1TSHR
SCHEMBL5176152 0.79 MAPT (0.48) HTTHCAR2LMNAMAPTHPGD
SCHEMBL11743721 0.79 MAPT (0.48) HTTHCAR2LMNAMAPTHPGD
SCHEMBL1070426 0.78 HCAR2 (0.71) HCAR2LMNAALDH1A1CA12AKR1B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105705580-A (meth) acrylic copolymer, resin composition, and molded article thereof 三菱瓦斯化学株式会社 2016-06-22 CN disclosed