SCHEMBL9851142

SCHEMBL9851142

CCc1ccc(O)cc1O.Cc1ccc(O)cc1O

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYR P14679 6/20 0.54
CYP3A4 P08684 2/20 0.50
ALOX5 P09917 2/20 0.50
TSHR P16473 2/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
ALOX15 P16050 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
RECQL P46063 1/20 0.44
HSP90AB1 P08238 1/20 0.44

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
SCHEMBL40375 0.89 TYR (0.65) TYRCYP3A4ALOX5TSHRMEN1
SCHEMBL29492456 0.89 TYR (0.65) TYRCYP3A4ALOX5TSHRMEN1
Benzene SCHEMBL28854209 0.85 TYR (0.60) TYRCYP3A4ALOX5TSHRMEN1
Methoxymethane SCHEMBL11437306 0.83 TYR (0.62) TYRCYP3A4ALOX5TSHRMEN1
SCHEMBL29375701 0.82
SCHEMBL63180 0.82
SCHEMBL11128456 0.82 TSHR (0.56) TYRCYP3A4TSHRMAPTALOX15
Resorcinol SCHEMBL20787089 0.82 TYR (0.56) TYRCYP3A4ALOX5TSHRMEN1
Formaldehyde SCHEMBL28674459 0.81 TSHR (0.50) TYRCYP3A4TSHRMAPTALOX15
Phenol SCHEMBL12231169 0.80 ALOX5 (0.58) TYRCYP3A4ALOX5TSHRMEN1

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-0435502-A1 Method of preparing high glass transition temperature novolak resins useful in high resolution photoresist compositions ROHM AND HAAS COMPANY (US) 1991-07-03 EP disclosed