SCHEMBL25009103

SCHEMBL25009103

CC(C)(SC1C=CC(O)=CC1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2B6 P20813 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL22787141 0.69 ESR2 (0.46) ESR1ESR2ALDH1A1CYP3A4
SCHEMBL21183288 0.60 ESR2 (0.39) ESR1ESR2ALDH1A1CYP3A4
SCHEMBL19774469 0.59 MAPT (0.38) ALDH1A1CYP3A4ALOX15
SCHEMBL776167 0.59 MAPK1 (0.48) ESR1ESR2ALDH1A1CYP3A4CYP2B6
SCHEMBL775520 0.59 MAPK1 (0.48) ESR1ESR2ALDH1A1CYP3A4CYP2B6
Hydrogen Peroxide SCHEMBL27577220 0.58 ALDH1A1 (0.55) ESR1ESR2ALDH1A1CYP3A4ALOX15
SCHEMBL13457486 0.57 ALDH1A1 (0.46) ESR1ESR2ALDH1A1CYP3A4CYP2B6
SCHEMBL11793700 0.57 MAPK1 (0.46) ESR1ESR2ALDH1A1CYP3A4CYP2B6
SCHEMBL775521 0.56 MAPK1 (0.44) ESR1ESR2ALDH1A1CYP3A4CYP2B6
SCHEMBL10012205 0.56 MAPK1 (0.44) ESR1ESR2ALDH1A1CYP3A4CYP2B6

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-4129974-A1 ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, METHOD FOR FORMING PATTERN, AND METHOD FOR PRODUCING ELECTRONIC DEVICE FUJIFILM Corporation (JP) 2023-02-08 EP disclosed