SCHEMBL9861540

SCHEMBL9861540

CCCc1c(O)ccc(CO)c1CO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.41
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
TYR P14679 3/20 0.37
KLF10 Q13118 1/20 0.36
PKM P14618 1/20 0.35
HTT P42858 2/20 0.34
ALOX5 P09917 2/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTR1A P08908 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL11697611 0.89 TYR (0.46) PRKCITYRPKMHTTALOX5
SCHEMBL15255041 0.87 CNR1 (0.43) PRKCICNR1CNR2HTTALOX5
SCHEMBL11698333 0.85 TYR (0.56) TYRHTTALOX5CYP3A4TSHR
SCHEMBL6906094 0.85 TYR (0.56) TYRHTTALOX5CYP3A4TSHR
SCHEMBL28593783 0.83 PRKCI (0.37) PRKCITYRHTTALOX5CYP3A4
SCHEMBL207165 0.83 KDM4E (0.41) TYRKLF10PKMHTTTSHR
SCHEMBL30027246 0.82 CNR1 (0.50) PRKCICNR1CNR2TYRHTT
SCHEMBL1760417 0.82 CNR1 (0.50) PRKCICNR1CNR2TYRHTT
SCHEMBL23354872 0.82 TYR (0.47) PRKCITYRKLF10PKMHTT
Formaldehyde SCHEMBL8521708 0.81 TYR (0.51) TYRHTTALOX5CYP3A4TSHR

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-0032062-B2 HIGH-MOLECULAR-WEIGHT NOVOLAK SUBSTITUTED PHENOLIC RESINS AND THEIR PREPARATION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-10-16 EP disclosed
EP-0032062-B1 HIGH-MOLECULAR-WEIGHT NOVOLAK SUBSTITUTED PHENOLIC RESINS AND THEIR PREPARATION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1985-04-03 EP disclosed
US-4345054-A High-molecular-weight novolak types substituted phenolic resins and process for preparation thereof MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-08-17 US disclosed
EP-0032062-A2 High-molecular-weight novolak substituted phenolic resins and their preparation MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-07-15 EP disclosed