SCHEMBL6046924

SCHEMBL6046924

CCCCCC=Cc1ccc(C=CCCCCC)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.55
KCNH2 Q12809 2/20 0.45
TRPV1 Q8NER1 2/20 0.43
FAAH O00519 2/20 0.43
MGLL Q99685 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL29101253 0.92 TNNC1 (0.50) TNNC1KCNH2TRPV1FAAH
SCHEMBL677480 0.92 TNNC1 (0.50) TNNC1KCNH2TRPV1FAAHMGLL
SCHEMBL15690345 0.90 TNNC1 (0.49) TNNC1KCNH2TRPV1FAAH
SCHEMBL15688742 0.90 TNNC1 (0.49) TNNC1KCNH2TRPV1FAAH
SCHEMBL6444338 0.90 TNNC1 (0.52) TNNC1TRPV1ALDH1A1
SCHEMBL6444344 0.90 TNNC1 (0.52) TNNC1TRPV1ALDH1A1
SCHEMBL714035 0.89 SIGMAR1 (0.49) TNNC1FAAH
SCHEMBL6289216 0.89 SIGMAR1 (0.49) TNNC1FAAH
SCHEMBL8471070 0.88 TNNC1 (0.55) TNNC1TRPV1ALDH1A1
SCHEMBL1140653 0.88 TNNC1 (0.51) TNNC1KCNH2TRPV1FAAHMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4529556-A Aryl substituted with hydroxy, epoxy or glycidyl groups THE DOW CHEMICAL COMPANY (US) 1985-07-16 US claimed
US-20060166033-A1 Polymerizable, luminescent compounds and mixtures, luminescent polymer materials and their use MERCK PATENT GMBH (DE) 2006-07-27 US disclosed
EP-1517975-A2 POLYMERIZABLE, LUMINESCENT COMPOUNDS AND MIXTURES, LUMINESCENT POLYMER MATERIALS AND THEIR USE MERCK PATENT GmbH (DE) 2005-03-30 EP disclosed
WO-2004003102-A2 POLYMERIZABLE, LUMINESCENT COMPOUNDS AND MIXTURES, LUMINESCENT POLYMER MATERIALS AND THEIR USE MERCK PATENT GMBH (DE) 2004-01-08 WO disclosed
US-4529556-A Aryl substituted with hydroxy, epoxy or glycidyl groups THE DOW CHEMICAL COMPANY (US) 1985-07-16 US disclosed
US-4529556-A Aryl substituted with hydroxy, epoxy or glycidyl groups THE DOW CHEMICAL COMPANY (US) 1985-07-16 US disclosed
US-4529556-A Aryl substituted with hydroxy, epoxy or glycidyl groups THE DOW CHEMICAL COMPANY (US) 1985-07-16 US disclosed