SCHEMBL10885252

SCHEMBL10885252

C=C(C)CC/C=C(\C)CCC=C(C)C

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
ALOX15 P16050 3/20 0.64
MAPT P10636 2/20 0.64
MEN1 O00255 2/20 0.64
CYP3A4 P08684 2/20 0.64
ALDH1A1 P00352 1/20 0.64
UGT1A1 P22309 1/20 0.64
SQLE Q14534 7/20 0.61
KDM4E B2RXH2 1/20 0.57
TSHR P16473 1/20 0.52

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
SCHEMBL11154898 1.00 KMT2A (0.73) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL11154896 1.00 KMT2A (0.73) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL10885257 1.00 KMT2A (0.73) KMT2AALOX15MAPTMEN1CYP3A4
Methoxymethane SCHEMBL11621990 0.94 KMT2A (0.64) KMT2AALOX15MAPTMEN1CYP3A4
Methoxymethane SCHEMBL11621985 0.94 KMT2A (0.64) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL1760707 0.90
SCHEMBL23802597 0.85 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4
Squalene SCHEMBL21823197 0.85 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL21639794 0.85 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL8013144 0.85 KMT2A (1.00) KMT2AALOX15MAPTMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117223721-A Alarm pheromone analogue combination, aphid control method and application 北京清源保生物科技有限公司 2023-12-15 CN claimed
US-4412089-A Process for the preparation of dienes and/or trienes SHELL OIL COMPANY (US) 1983-10-25 US claimed
CN-117223721-A Alarm pheromone analogue combination, aphid control method and application 北京清源保生物科技有限公司 2023-12-15 CN disclosed
CN-117223721-A Alarm pheromone analogue combination, aphid control method and application 北京清源保生物科技有限公司 2023-12-15 CN disclosed
WO-2023137133-A2 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES BASF SE (DE) 2023-07-20 WO disclosed
US-9663440-B2 Cross metathesis of poly-branched poly-olefins MATERIA, INC. (US) 2017-05-30 US disclosed
US-20140356926-A1 Novel sesquiterpene synthase gene and protein UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2014-12-04 US disclosed
EP-0073532-B1 PROCESS FOR THE PREPARATION OF 2,6-DIMETHYL-1,5-HEPTADIENE AND/OR 2,6,10-TRIMETHYL-1,5,9-UNDECATRIENE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-01-22 EP disclosed
EP-0073532-B1 PROCESS FOR THE PREPARATION OF 2,6-DIMETHYL-1,5-HEPTADIENE AND/OR 2,6,10-TRIMETHYL-1,5,9-UNDECATRIENE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-01-22 EP disclosed
US-4412089-A Process for the preparation of dienes and/or trienes SHELL OIL COMPANY (US) 1983-10-25 US disclosed
US-4412089-A Process for the preparation of dienes and/or trienes SHELL OIL COMPANY (US) 1983-10-25 US disclosed
EP-0073532-A1 Process for the preparation of 2,6-Dimethyl-1,5-Heptadiene and/or 2,6,10-Trimethyl-1,5,9-Undecatriene SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1983-03-09 EP disclosed
EP-0073532-A1 Process for the preparation of 2,6-Dimethyl-1,5-Heptadiene and/or 2,6,10-Trimethyl-1,5,9-Undecatriene SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1983-03-09 EP disclosed