Butadiene

Butadiene

SCHEMBL5595802

C=CC=C.C=COC(=O)C(=C)C

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TSHR P16473 4/20 0.37
THRB P10828 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
HSD17B10 Q99714 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL35971 0.95
Benzene SCHEMBL7176796 0.93 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL11256472 0.92
SCHEMBL11854992 0.92
SCHEMBL11590228 0.92
Hydrochloric Acid SCHEMBL28368190 0.90 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTDP1HSD17B10
Bicarbonate SCHEMBL28402036 0.90 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL8965764 0.88 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1HSD17B10
Methacrylic Acid SCHEMBL5356962 0.88 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1
Cyclopropane SCHEMBL3458986 0.88 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7205035-B2 Thermoset composition, method, and article GENERAL ELECTRIC COMPANY (US) 2007-04-17 US disclosed
EP-1497373-B1 THERMOSET COMPOSITION, METHOD, AND ARTICLE GEN ELECTRIC (US) 2007-02-07 EP disclosed
EP-1497372-B1 THERMOSET COMPOSITION, METHOD AND ARTICLE GEN ELECTRIC (US) 2007-01-17 EP disclosed
US-6878782-B2 Thermoset composition, method, and article GENERAL ELECTRIC (US) 2005-04-12 US disclosed
EP-1497372-A1 THERMOSET COMPOSITION, METHOD AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2005-01-19 EP disclosed
EP-1497373-A1 THERMOSET COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2005-01-19 EP disclosed
US-20030220460-A1 THERMOSET COMPOSITION, METHOD, AND ARTICLE CITIBANK, N.A., AS COLLATERAL AGENT 2003-11-27 US disclosed
US-20030215588-A1 Thermoset composition, method, and article CITIBANK, N.A., AS COLLATERAL AGENT 2003-11-20 US disclosed
WO-2003087223-A1 THERMOSET COMPOSITION, METHOD AND ARTICLE GENERAL ELECTRIC COMPANY (A NEW YORK CORPORATION) (US) 2003-10-23 WO disclosed
WO-2003087224-A1 THERMOSET COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (A NEW YORK CORPORATION) (US) 2003-10-23 WO disclosed
US-20020169256-A1 Thermoset composition, method, and article SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2002-11-14 US disclosed