SCHEMBL9876167

SCHEMBL9876167

CCCCCCCCCCCCCCCCCCc1ccc2cc(C(C)C)cccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPT P10636 1/20 0.40
TYR P14679 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PPARA Q07869 2/20 0.39
ELANE P08246 2/20 0.39
CTSG P08311 2/20 0.39
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL9875860 1.00 MEN1 (0.40) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL9874563 1.00 MEN1 (0.40) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL9876048 1.00 MEN1 (0.40) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL9876409 1.00 MEN1 (0.40) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL9876010 1.00 MEN1 (0.40) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL9875245 0.94 CTSS (0.39) TP53CYP3A4MAPTTYRALOX15
SCHEMBL9876309 0.88 CTSS (0.44) TP53CYP3A4ALOX5MAPTTYR
SCHEMBL9876249 0.83 HTR2A (0.47) MEN1TP53CYP3A4MAPTTSHR
SCHEMBL9876443 0.83 HTR2A (0.47) MEN1TP53CYP3A4MAPTTSHR
SCHEMBL9876431 0.83 GCGR (0.37) PPARABIDMCL1BCL2L1BAK1

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
US-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed