SCHEMBL9504205

SCHEMBL9504205

CCCCCCc1cc(CCCC(C)C)ccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.51
PPARA Q07869 1/20 0.48
PTGS2 P35354 3/20 0.47
ESR1 P03372 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
TACR2 P21452 2/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A3 Q01959 2/20 0.47
TP53 P04637 2/20 0.47
CYP3A4 P08684 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
SHBG P04278 1/20 0.47
HSPD1 P10809 1/20 0.47
ADRB3 P13945 1/20 0.47
HTR2C P28335 1/20 0.47
HSPE1 P61604 1/20 0.47

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
SCHEMBL9502998 1.00 KAT8 (0.51) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL27708224 0.94 KAT8 (0.48) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL8465007 0.91 GABRA1 (0.50) KAT8CYP3A4MEN1ALOX15TSHR
SCHEMBL8461732 0.91 GABRA1 (0.50) KAT8CYP3A4MEN1ALOX15TSHR
SCHEMBL8204385 0.91 GABRA1 (0.53) PTGS2ESR1ADORA3SLC6A2SLC6A3
SCHEMBL6212332 0.89 KAT8 (0.61) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL1024221 0.89 KAT8 (0.61) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL1022113 0.89 KAT8 (0.61) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL9651340 0.89 KAT8 (0.61) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL11783346 0.89 KAT8 (0.61) KAT8PPARAPTGS2ESR1ADRA2A

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