SCHEMBL28293306

SCHEMBL28293306

CCCCCCCCCCCCc1ccc(CC)c(C)c1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.56
TP53 P04637 2/20 0.48
CYP3A4 P08684 2/20 0.48
MEN1 O00255 1/20 0.48
ALOX5 P09917 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
LIPG Q9Y5X9 1/20 0.46
BID P55957 3/20 0.42
MCL1 Q07820 3/20 0.42
BCL2L1 Q07817 2/20 0.42
BAK1 Q16611 2/20 0.42
KAT8 Q9H7Z6 2/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
EP300 Q09472 1/20 0.42

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
Water SCHEMBL28055285 0.98 TYR (0.55) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL19143776 0.91 TYR (0.46) TYRTP53CYP3A4MEN1ALOX5
Ethylamine SCHEMBL27542476 0.91 TYR (0.49) TYRTP53CYP3A4MEN1ALOX5
Bromide SCHEMBL27995436 0.89 TYR (0.47) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11527166 0.85 TYR (0.55) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL6057017 0.85 TYR (0.55) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27680275 0.85 TYR (0.55) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL17637377 0.82 TYR (0.45) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL17192327 0.82 TYR (0.45) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL17192324 0.82 TYR (0.45) TYRTP53CYP3A4MEN1ALOX5

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
CN-109777639-A It is a kind of for air-conditioning and the disinfection of general object hard surface and the preparation of hygiene and preparation method thereof 江苏今日卫生用品有限公司 2019-05-21 CN disclosed