SCHEMBL12379537

SCHEMBL12379537

Cc1ccc(/C=C/c2ccc(-c3ccc(/C=C/c4ccc(N(C)c5ccc(CCCCCCCCCCCCc6ccc7c(c6)CC7)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.37
IGF1R P08069 1/20 0.36
ALOX15 P16050 1/20 0.36
MLNR O43193 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
SCHEMBL12379499 0.93 IGF1R (0.41) IGF1RALOX15MLNR
SCHEMBL12619692 0.85 SIGMAR1 (0.39) IGF1RALOX15MLNR
SCHEMBL12619714 0.85 SIGMAR1 (0.35) IGF1RALOX15MLNR
SCHEMBL12379497 0.85 SIGMAR1 (0.35) IGF1RALOX15MLNR
SCHEMBL12379519 0.85 CHKA (0.37) IGF1RALOX15MLNR
SCHEMBL12379486 0.85 SIGMAR1 (0.35) IGF1RALOX15MLNR
SCHEMBL12379502 0.84 IGF1R (0.35) IGF1RALOX15MLNR
SCHEMBL12619851 0.84 IGF1R (0.42) IGF1RALOX15MLNR
SCHEMBL12619684 0.84 MAPT (0.37) KCNH2
SCHEMBL12619686 0.84 NFE2L2 (0.39) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110198573-A1 CHARGE-TRANSPORTING POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-18 US disclosed