SCHEMBL7763335

SCHEMBL7763335

CCC(C)CCC=C(C)C.CCC(C)CCC=C(C)C.CCC(C)CCC=C(C)C.CCC(C)CCC=C(C)C.O[SiH3]

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.59
ALDH1A1 P00352 2/20 0.59
TSHR P16473 1/20 0.44
USP2 O75604 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GGPS1 O95749 2/20 0.36
FDPS P14324 2/20 0.36
SRC P12931 1/20 0.35
NFE2L2 Q16236 1/20 0.35

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
SCHEMBL3116530 0.95 ALOX15 (0.64) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL1198833 0.95 ALOX15 (0.64) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL1198831 0.95 ALOX15 (0.64) ALOX15ALDH1A1TSHRUSP2TDP1
Ammonia Solution, Strong SCHEMBL8967236 0.93 ALOX15 (0.61) ALOX15ALDH1A1TSHRUSP2TDP1
Alcohol SCHEMBL28141696 0.91 ALOX15 (0.65) ALOX15ALDH1A1TSHRUSP2TDP1
Formic Acid SCHEMBL28284615 0.87 ALOX15 (0.55) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL21962026 0.87 ALOX15 (0.61) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL2844694 0.87 ALOX15 (0.61) ALOX15ALDH1A1TSHRUSP2TDP1
Acetic Acid SCHEMBL28162362 0.87 ALOX15 (0.55) ALOX15ALDH1A1TSHRUSP2TDP1
Nitrous Acid SCHEMBL781184 0.85 ALOX15 (0.53) ALOX15ALDH1A1TSHRUSP2TDP1

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
WO-2001079212-A1 SILICON DERIVATIVES OF FRAGRANT, FLAVOURING AND MEDICINAL SUBSTANCES KIREEV VYACHESLAV VASILIEVICH (RU) 2001-10-25 WO disclosed