SCHEMBL3699760

SCHEMBL3699760

Cc1cc(C)cc(C(c2ccc(S)cc2)c2cc(C)cc(C)c2)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 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
SCHEMBL4950926 0.80 ALDH1A1 (0.44) ACHEALDH1A1TSHR
SCHEMBL901124 0.80 IDO1 (0.42)
SCHEMBL27955728 0.79 ACHE (0.48) ACHEALDH1A1TSHR
SCHEMBL3697491 0.79 ACHE (0.48) ACHEALDH1A1TSHR
SCHEMBL3696722 0.77 ESR1 (0.46) ACHEALDH1A1
SCHEMBL3696526 0.77 CYP19A1 (0.50) TSHR
SCHEMBL3704074 0.77 ALDH1A1 (0.46) ALDH1A1
SCHEMBL3690665 0.77 ACHE (0.46) ACHEALDH1A1
SCHEMBL3689667 0.77 LMNA (0.35) ALDH1A1
SCHEMBL21895716 0.76 ACHE (0.38) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741240-B2 Transition metal compounds for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-22 US claimed
EP-1753773-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION ExxonMobil Chemical Patents Inc. (US) 2007-02-21 EP claimed
WO-2005118605-A1 TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2005-12-15 WO claimed