SCHEMBL9504248

SCHEMBL9504248

CCCCCCCCc1ccc(C)cc1O

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.71
MAPT P10636 3/20 0.71
CYP3A4 P08684 2/20 0.71
MEN1 O00255 2/20 0.71
HTT P42858 2/20 0.71
KMT2A Q03164 2/20 0.71
TP53 P04637 1/20 0.71
ALOX5 P09917 1/20 0.71
ALOX15 P16050 1/20 0.71
TSHR P16473 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
CNR2 P34972 2/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
GAA P10253 2/20 0.48
HPGD P15428 2/20 0.48
USP2 O75604 1/20 0.48
GLA P06280 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48

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
SCHEMBL3358965 1.00 TYR (0.71) TYRMAPTCYP3A4MEN1HTT
SCHEMBL8402868 1.00 TYR (0.71) TYRMAPTCYP3A4MEN1HTT
SCHEMBL8590686 1.00 TYR (0.71) TYRMAPTCYP3A4MEN1HTT
Amylmetacresol SCHEMBL29897625 0.98 TYR (0.68) TYRMAPTCYP3A4MEN1HTT
Amylmetacresol SCHEMBL302197 0.98 TYR (0.68) TYRMAPTCYP3A4MEN1HTT
SCHEMBL901087 0.92 TYR (0.69) TYRMAPTCYP3A4MEN1HTT
SCHEMBL8400481 0.92 TYR (0.58) TYRMAPTCYP3A4MEN1HTT
Butane SCHEMBL28342368 0.91 TYR (0.67) TYRMAPTCYP3A4MEN1HTT
SCHEMBL28329857 0.87 TYR (0.62) TYRMAPTCYP3A4MEN1HTT
SCHEMBL27546869 0.87 TYR (0.55) TYRMAPTCYP3A4MEN1HTT

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-0318941-B1 DEVELOPER FOR PRESSURE-SENSITIVE RECORDING SHEETS, AQUEOUS DISPERSION OF THE DEVELOPER AND METHOD FOR PREPARING THE DEVELOPER Sanko Kaihatsu Kagaku Kenkyusho (JP) 1993-06-09 EP disclosed
US-5118443-A DEVELOPER FOR PRESSURE-SENSITIVE RECORDING SHEETS, AQUEOUS DISPERSION OF THE DEVELOPER AND METHOD FOR PREPARING THE DEVELOPER SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-06-02 US disclosed
EP-0318941-A2 Developer for pressure-sensitive recording sheets, aqueous dispersion of the developer and method for preparing the developer Sanko Kaihatsu Kagaku Kenkyusho (JP) 1989-06-07 EP disclosed