SCHEMBL14944896

SCHEMBL14944896

CCN(CC)c1ccc(N=Nc2cc(Cl)c(S(=O)(=O)F)cc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.39
KMT2A Q03164 10/20 0.39
MEN1 O00255 9/20 0.39
TDP1 Q9NUW8 7/20 0.39
KDM4E B2RXH2 6/20 0.39
LMNA P02545 5/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 9/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
L3MBTL1 Q9Y468 7/20 0.35
HPGD P15428 4/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP1A2 P05177 1/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL8045149 0.82 KMT2A (0.39) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL8045147 0.82 KMT2A (0.39) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL14945025 0.82 MAPT (0.33) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL14944478 0.80 MAPT (0.43) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL17279090 0.78 TSHR (0.43) MAPTKMT2ATDP1KDM4ELMNA
SCHEMBL22191800 0.77 LMNA (0.43) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL7768216 0.75 MAPT (0.48) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL7768219 0.75 MAPT (0.48) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL7769136 0.74 MAPT (0.40) MAPTKMT2AMEN1TDP1KDM4E
SCHEMBL7769138 0.74 MAPT (0.40) MAPTKMT2AMEN1TDP1KDM4E

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
US-8506652-B2 Disperse dyes COLOURTEX INDUSTRIES LIMITED (IN) 2013-08-13 US disclosed
US-20130117947-A1 DISPERSE DYES COLOURTEX INDUSTRIES LIMITED (IN) 2013-05-16 US disclosed