SCHEMBL3663788

SCHEMBL3663788

C=C(C)CCC=C(C)CC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
ALOX15 P16050 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
UGT1A1 P22309 1/20 0.38
SQLE Q14534 7/20 0.37
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL3663786 1.00 KMT2A (0.42) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL1486008 0.86 KMT2A (0.34) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL11443586 0.83 KMT2A (0.41) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL9244268 0.83 KMT2A (0.46) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL11443587 0.83 KMT2A (0.41) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL2627756 0.80 BTN3A1 (0.45) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL7174933 0.79 TSHR (0.65) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL28246381 0.79 KMT2A (0.38) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL21936846 0.79 TSHR (0.65) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL3699306 0.79 KMT2A (0.46) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203512-A1 THERMOPLASTIC OLEFIN COMPOSITION WITH IMPROVED HEAT DISTORTION TEMPERATURE Dow Global Technologies Inc. (US) 2010-07-07 EP disclosed
WO-2009042602-A1 THERMOPLASTIC OLEFIN COMPOSITION WITH IMPROVED HEAT DISTORTION TEMPERATURE DOW GLOBAL TECHNOLOGIES INC (US) 2009-04-02 WO disclosed
US-6441177-B1 Tertiary amines HOFFMANN-LA ROCHE INC. 2002-08-27 US disclosed
US-6034275-A FUGICIDES; ATICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 2000-03-07 US disclosed
EP-0334941-B1 INCREASING THE LEVEL OF 2-METHYL-2-BUTENE IN ISOAMYLENE EXXON CHEMICAL PATENTS INC (US) 1995-04-26 EP disclosed
US-5073663-A Isomerizing 2-methyl-1-butene in presence of tertiary alky ether and acidic ion exchange resin catalyst EXXON CHEMICAL PATENTS INC. (US) 1991-12-17 US disclosed
EP-0334941-A1 INCREASING THE LEVEL OF 2-METHYL-2-BUTENE IN ISOAMYLENE EXXON CHEMICAL PATENTS INC. (US) 1989-10-04 EP disclosed
WO-1989002882-A1 INCREASING THE LEVEL OF 2-METHYL-2-BUTENE IN ISOAMYLENE EXXON CHEMICAL PATENTS, INC. (US) 1989-04-06 WO disclosed