SCHEMBL4311271

SCHEMBL4311271

c1cc(CSc2c[nH]nn2)ccc1CSc1c[nH]nn1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.36
HSD17B10 Q99714 1/20 0.36
RAB9A P51151 6/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 4/20 0.34
ABL1 P00519 1/20 0.34
RIN1 Q13671 1/20 0.34
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 4/20 0.33
MEN1 O00255 2/20 0.33
HTT P42858 2/20 0.33
KMT2A Q03164 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 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
SCHEMBL6760838 0.90 ABL1 (0.45) POLBHSD17B10RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7164011 0.89 ABL1 (0.44) POLBHSD17B10RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6588550 0.74
SCHEMBL9994085 0.74
SCHEMBL8442599 0.74
SCHEMBL11486895 0.71
SCHEMBL3922217 0.69
SCHEMBL158090 0.69
SCHEMBL1682739 0.69
SCHEMBL23457494 0.69 CYP1A2 (0.37) RAB9ASMN1; SMN2ALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713794-B1 HETEROCYCLE GRAFTED MONOMERS AND RELATED POLYMERS AND HYBRID INORGANIC-ORGANIC POLYMER MEMBRANES TOYOTA TECHNICAL CT U S A INC (US) 2014-05-07 EP disclosed
US-7576165-B2 Having an acid group attached to the hybrid inorganic-organic matrix; and a nitrogen-containing heterocycle attached to the hybrid inorganic-organic matrix, wherein the nitrogen-containing heterocycle is selected from 1,2,4-triazole,1,2,3-triazole, 1H-benzotriazole, pyrimidine, for example; fuel cells GEORGIA INSTITUTE OF TECHNOLOGY (US) 2009-08-18 US disclosed
EP-1713794-A2 HETEROCYCLE GRAFTED MONOMERS AND RELATED POLYMERS AND HYBRID INORGANIC-ORGANIC POLYMER MEMBRANES Toyota Technical Center, U.S.A., Inc. (US) 2006-10-25 EP disclosed
US-20060111530-A1 Heterocycle grafted monomers and related polymers and hybrid inorganic-organic polymer membranes TOYOTA MOTOR CORPORATION (JP) 2006-05-25 US disclosed
WO-2005072413-A2 HETEROCYCLE GRAFTED MONOMERS AND RELATED POLYMERS AND HYBRID INORGANIC-ORGANIC POLYMER MEMBRANES TOYOTA TECHNICAL CENTER, USA, INC. (US) 2005-08-11 WO disclosed