SCHEMBL10697509

SCHEMBL10697509

CC(OOc1ccccc1C(=O)O)Oc1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 7/20 0.45
HPGD P15428 6/20 0.45
HSD17B10 Q99714 6/20 0.45
TSHR P16473 2/20 0.44
ESR1 P03372 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
HMGB1 P09429 1/20 0.44
GGT1 P19440 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
BLM P54132 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 2/20 0.43

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
SCHEMBL9551796 0.84 KDM4E (0.49) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10697508 0.80 HTT (0.47) HTTTP53ALDH1A1KDM4EHPGD
SCHEMBL9395760 0.79 HPGD (0.48) HTTTP53ALDH1A1KDM4EHPGD
SCHEMBL10599630 0.79 KDM4E (0.44) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10698538 0.79 HSD17B10 (0.41) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL17010754 0.78 KDM4E (0.56) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10619157 0.78 KDM4E (0.59) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9129863 0.77 KDM4E (0.54) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10698350 0.77 KDM4E (0.50) HTTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10595073 0.76 PPARG (0.48) HTTTP53ALDH1A1KDM4EHPGD

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
EP-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed