SCHEMBL1900260

SCHEMBL1900260

Cc1ccc(N(c2ccccc2)c2cccc(-c3ccccc3)c2N(c2ccccc2)c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.38
CYP2C19 P33261 2/20 0.35
LMNA P02545 2/20 0.35
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
CA2 P00918 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CRHR1 P34998 2/20 0.33
C5AR1 P21730 1/20 0.33
APP P05067 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 1/20 0.33
HPRT1 P00492 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 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
SCHEMBL8366035 0.98 HTR7 (0.38) HTR7CYP2C19LMNACA12CA9
SCHEMBL5419249 0.90 ALDH1A1 (0.41) CYP2C19PDCD1CD274SMN1; SMN2CRHR1
SCHEMBL3824743 0.90 ALDH1A1 (0.35) HTR7CYP2C19PDCD1CD274SMN1; SMN2
SCHEMBL27935316 0.88 HTR7 (0.38) HTR7CYP2C19LMNAPDCD1CD274
SCHEMBL17459247 0.88 HTR7 (0.38) HTR7CYP2C19LMNAPDCD1CD274
SCHEMBL3877945 0.88 HTR7 (0.39) HTR7LMNAPDCD1CD274SMN1; SMN2
SCHEMBL29127434 0.87 KDM1A (0.39) CYP2C19LMNASMN1; SMN2TDP1L3MBTL1
SCHEMBL7906917 0.86 CYP2C19 (0.39) HTR7CYP2C19LMNACA12CA9
SCHEMBL30021779 0.86 ALDH1A1 (0.35) HTR7CYP2C19PDCD1CD274SMN1; SMN2
SCHEMBL7757061 0.84 CYP2C19 (0.40) HTR7CYP2C19LMNACA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011056778-A2 INTERLAYER FOR ORGANIC SOLAR CELLS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2011-05-12 WO claimed
WO-2011056778-A2 INTERLAYER FOR ORGANIC SOLAR CELLS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2011-05-12 WO disclosed