SCHEMBL886936

SCHEMBL886936

C=CCCCCCCCCCC(C)CC=C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
MAPT P10636 3/20 0.40
ABCC4 O15439 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.39
USP2 O75604 4/20 0.38
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
TRPA1 O75762 1/20 0.33
RECQL P46063 1/20 0.32
LPAR3 Q9UBY5 2/20 0.31
LPAR2 Q9HBW0 1/20 0.31

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
SCHEMBL624843 1.00 TSHR (0.46) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL3690718 1.00 TSHR (0.46) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL183421 1.00 TSHR (0.46) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2932240 0.98 TSHR (0.42) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL5078159 0.94 TSHR (0.41) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL8111294 0.94 TSHR (0.41) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL2136218 0.91 TSHR (0.42) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL4052642 0.88 TSHR (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL10701544 0.86 MAPT (0.39) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL7296275 0.85 TSHR (0.41) TSHRMAPTABCC4ALDH1A1LMNA

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
EP-1859083-B1 FIBERS MADE FROM COPOLYMERS OF ETHYLENE/ALPHA-OLEFINS DOW GLOBAL TECHNOLOGIES LLC (US) 2012-01-18 EP disclosed
EP-1506259-A1 EXTRUDABLE THERMOPLASTIC COMPOSITIONS 3M Innovative Properties Company (US) 2005-02-16 EP disclosed
WO-2003099935-A1 EXTRUDABLE THERMOPLASTIC COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-04 WO disclosed
US-6444736-B1 MIXTURE; USING COORDINATION CATALYST CHISSO CORPORATION (JP) 2002-09-03 US disclosed
EP-0112568-B1 GLASS-REINFORCED POLYMER COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-11-05 EP disclosed