SCHEMBL8776754

SCHEMBL8776754

C=COC(=O)c1cccc(Cl)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 1/20 0.41
TSHR P16473 2/20 0.39
PLAU P00749 2/20 0.38
PLAT P00750 2/20 0.38
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
P2RX1 P51575 1/20 0.38
P2RX4 Q99571 1/20 0.38
P2RX7 Q99572 1/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
TAS1R2 Q8TE23 2/20 0.36

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
SCHEMBL194413 0.84 CES2 (0.52) CES2CES1HPGDCYP1A2ESR1
SCHEMBL22231498 0.80 KDM4E (0.44) KLKB1TSHRPLAUPLATF2
SCHEMBL11727113 0.80 ESR1 (0.49) TSHRCES2CES1HPGDCYP1A2
SCHEMBL8850990 0.79 CYP3A4 (0.40) TSHRHPGDALDH1A1ALOX15CYP3A4
SCHEMBL15175 0.77 CYP3A4 (0.55) TSHRALDH1A1ALOX15CYP3A4KDM4E
SCHEMBL8850815 0.77 CYP3A4 (0.38) TSHRHPGDALDH1A1ALOX15CYP3A4
SCHEMBL2796868 0.77 LMNA (0.55) KLKB1TSHRPLAUPLATF2
SCHEMBL28079925 0.76 CYP3A4 (0.46) TSHRPLAUALDH1A1ALOX15CYP3A4
Ethylene SCHEMBL29113890 0.75 CYP3A4 (0.53) TSHRALDH1A1ALOX15CYP3A4KDM4E
SCHEMBL194863 0.74 TSHR (0.57) TSHRHPGDCYP1A2ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0490515-B1 Method for preparing lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 1997-10-15 EP disclosed
US-5480762-A Method for preparing lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed
EP-0490515-A1 Method for preparing lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 1992-06-17 EP disclosed