SCHEMBL9011361

SCHEMBL9011361

C(OCC1CO1)C1CO1.C=CC(=O)Oc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
TSHR P16473 4/20 0.51
HPGD P15428 3/20 0.51
MAPT P10636 3/20 0.51
TP53 P04637 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP1A2 P05177 1/20 0.51
PPARG P37231 1/20 0.51
HIF1A Q16665 1/20 0.51
THRB P10828 2/20 0.39
MIF P14174 2/20 0.39
ESR1 P03372 3/20 0.37
ESR2 Q92731 3/20 0.37
CYP3A4 P08684 2/20 0.37
AR P10275 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
HTR6 P50406 1/20 0.37
ESRRG P62508 1/20 0.37

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
SCHEMBL9237285 0.88 ALDH1A1 (0.45) ALDH1A1TSHRHPGDMAPTTP53
Bisphenol A SCHEMBL28458240 0.88 ALDH1A1 (0.49) ALDH1A1TSHRHPGDMAPTTP53
SCHEMBL966896 0.87 ALDH1A1 (0.70) ALDH1A1TSHRHPGDMAPTTP53
Bicarbonate SCHEMBL10771552 0.86 TSHR (0.53) ALDH1A1TSHRHPGDMAPTTP53
Bisphenol A SCHEMBL3627590 0.85 HPGD (0.49) ALDH1A1TSHRHPGDMAPTTP53
SCHEMBL7923720 0.85 KMT2A (0.50) ALDH1A1TSHRHPGDMAPTTP53
Bisphenol A SCHEMBL50024 0.83 TSHR (0.61) ALDH1A1TSHRHPGDMAPTTP53
SCHEMBL16655607 0.83 TSHR (0.61) ALDH1A1TSHRHPGDMAPTTP53
SCHEMBL644250 0.83 ESR1 (0.53) ALDH1A1TSHRHPGDMAPTMEN1
Methacrylic Acid SCHEMBL3864596 0.82 KMT2A (0.47) ALDH1A1TSHRHPGDMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0459240-B1 Electrophotographic light-sensitive material FUJI PHOTO FILM CO LTD (JP) 1996-11-20 EP disclosed
US-5229240-A ELECTROPHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1993-07-20 US disclosed
US-5188917-A Crosslinked block polymer FUJI PHOTO FILM CO., LTD. (JP) 1993-02-23 US disclosed
EP-0459240-A1 Electrophotographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1991-12-04 EP disclosed