SCHEMBL12379520

SCHEMBL12379520

Cc1ccc(-c2cc(-c3ccc(N(C)c4ccccc4)cc3)cc(-c3cc(CCCCc4ccc5c(c4)CC5)cc(CCCCc4ccc5c(c4)CC5)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHKA P35790 3/20 0.37
SIGMAR1 Q99720 2/20 0.34
GRIN2B Q13224 2/20 0.33
IGF1R P08069 1/20 0.33
ALOX15 P16050 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
HTR2C P28335 1/20 0.32
KCNH2 Q12809 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL12619692 0.89 SIGMAR1 (0.39) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12379499 0.87 IGF1R (0.41) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12619690 0.86 CHKA (0.35) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12379519 0.86 CHKA (0.37) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12379497 0.86 SIGMAR1 (0.35) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12379486 0.86 SIGMAR1 (0.35) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12619714 0.86 SIGMAR1 (0.35) CHKASIGMAR1GRIN2BIGF1RALOX15
SCHEMBL12379527 0.86 SIGMAR1 (0.36) CHKASIGMAR1GRIN2BDRD2DRD3
SCHEMBL12379573 0.82 HSD11B1 (0.40) CHKASIGMAR1KCNH2
SCHEMBL12379528 0.82 SIGMAR1 (0.37) CHKASIGMAR1GRIN2BIGF1RALOX15

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