SCHEMBL28279472

SCHEMBL28279472

CC(C)=CCC/C(C)=C/COCCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 3/20 0.48
FDFT1 P37268 1/20 0.48
FNTA P49354 5/20 0.47
FNTB P49356 3/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 2/20 0.46
CYP3A4 P08684 2/20 0.46
MAPT P10636 2/20 0.44
UGT1A1 P22309 1/20 0.44
SQLE Q14534 1/20 0.43
PGGT1B P53609 2/20 0.43

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
SCHEMBL22319795 0.88 PTPN1 (0.52) ALOX15ALDH1A1KMT2AFDFT1FNTA
Geraniol SCHEMBL28279474 0.85 KMT2A (0.63) ALOX15ALDH1A1KMT2AKDM4EMEN1
SCHEMBL24183169 0.83 KMT2A (0.64) ALOX15ALDH1A1KMT2AFDFT1FNTA
SCHEMBL9398181 0.83 TDP1 (0.42) ALOX15ALDH1A1
SCHEMBL28820216 0.82 PTPN1 (0.55) FDFT1
SCHEMBL28854298 0.81 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL27649625 0.81 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL492962 0.81 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL3400313 0.81 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL492960 0.81 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109661180-A Composition and production and preparation method thereof for sports achievement 西雅图咖米公司 2019-04-19 CN disclosed
CN-109640703-A Composition and production and preparation method thereof for mental alertness 西雅图咖米公司 2019-04-16 CN disclosed
CN-109640704-A Composition and production and preparation method thereof for postexercise recovery 西雅图咖米公司 2019-04-16 CN disclosed
CN-109640705-A Mineral composition and its preparation and application 西雅图咖米公司 2019-04-16 CN disclosed
CN-109561727-A Health control composition and its preparation and application 西雅图咖米公司 2019-04-02 CN disclosed