SCHEMBL13299501

SCHEMBL13299501

CCCCCCCCN(CCCCCCCC)c1nc(N(C)CN(C)c2nc(N(CCCCCCCC)CCCCCCCC)nc(N(CCCCCCCC)CCCCCCCC)n2)nc(N(CCCCCCCC)CCCCCCCC)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.41
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC29A1 Q99808 2/20 0.37
CRHR1 P34998 4/20 0.35
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GPR84 Q9NQS5 2/20 0.33
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31

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
SCHEMBL13299504 0.96 DNM1 (0.39) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL15248599 0.92 CRHR1 (0.43) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL15248721 0.89 CRHR1 (0.44) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL2535675 0.85 MAPT (0.48) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL26771566 0.84 CRHR1 (0.48) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL21081373 0.83 MAPT (0.47) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL15248720 0.83 CRHR1 (0.40) MAPTCRHR1
SCHEMBL13299494 0.82 SLC29A1 (0.37) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL13299493 0.82 DNM1 (0.36) DNM1MAPTSMN1; SMN2SLC29A1CRHR1
SCHEMBL26771664 0.82 DNM1 (0.36) DNM1MAPTSMN1; SMN2SLC29A1CRHR1

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-20100137539-A1 Visible light-absorbing complex, triazine-based dendritic polymer, and organic photovoltiac device NATIONAL CHI NAN UNIVERSITY (TW) 2010-06-03 US disclosed