SCHEMBL12379499

SCHEMBL12379499

Cc1ccc(-c2ccc(N(C)c3ccc(CCCCCCc4ccc5c(c4)CC5)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
MLNR O43193 2/20 0.37
SIGMAR1 Q99720 3/20 0.36
HRH1 P35367 1/20 0.35
CHKA P35790 1/20 0.34
CHKB Q9Y259 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34
MCHR1 Q99705 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
CHRM1 P11229 1/20 0.33
HTR2A P28223 1/20 0.33
RARB P10826 1/20 0.33
GRIN2B Q13224 1/20 0.33
FDFT1 P37268 1/20 0.33

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
SCHEMBL12379537 0.93 KCNH2 (0.37) IGF1RALOX15MLNR
SCHEMBL12619692 0.92 SIGMAR1 (0.39) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12619714 0.91 SIGMAR1 (0.35) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12379497 0.91 SIGMAR1 (0.35) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12379519 0.91 CHKA (0.37) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12379486 0.91 SIGMAR1 (0.35) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12379502 0.91 IGF1R (0.35) IGF1RALOX15MLNRSIGMAR1HRH1
SCHEMBL12619851 0.90 IGF1R (0.42) IGF1RALOX15MLNRHRH1MEN1
SCHEMBL12379528 0.87 SIGMAR1 (0.37) IGF1RALOX15MLNRSIGMAR1CHKA
SCHEMBL12619690 0.87 CHKA (0.35) IGF1RALOX15MLNRSIGMAR1CHKA

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