SCHEMBL5493729

SCHEMBL5493729

Nc1ccccc1N(c1ccccc1)c1ccccc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
MAPT P10636 4/20 0.52
CYP3A4 P08684 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.43
ALOX15 P16050 2/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
TSHR P16473 5/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
CHEK1 O14757 1/20 0.35
NEK2 P51955 1/20 0.35
LIMK1 P53667 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
SCHEMBL388104 0.95 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL30221915 0.95 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL29520359 0.92 ALDH1A1 (0.48) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL2009250 0.92 ALDH1A1 (0.48) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL29878293 0.88 CYP3A4 (0.45) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL29986213 0.86 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8663873 0.86 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL19763077 0.85 ALDH1A1 (0.54) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL19763076 0.85 ALDH1A1 (0.54) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL15561429 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTCYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1172466-B1 PROCESS FOR PRODUCING A META-TYPE WHOLLY AROMATIC POLYAMIDE FIBER TEIJIN LTD (JP) 2007-01-10 EP disclosed
US-6569366-B1 Wet spinning, drawing, heat treatment; poly-meta-phenylenediamine isophthalamide TEIJIN LIMITED (JP) 2003-05-27 US disclosed
EP-1172466-A1 META-FORM WHOLLY AROMATIC POLYAMIDE FIBER AND PROCESS FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 2002-01-16 EP disclosed
US-4389521-A AROMATIC POLYAMIDE TEIJIN LIMITED (JP) 1983-06-21 US disclosed
EP-0008126-B1 AROMATIC POLYAMIDE COMPOSITION TEIJIN LIMITED (JP) 1982-12-29 EP disclosed
US-4250073-A HIGH CONCENTRATION OF POLYMER POSSIBLE; FILAMENTS AND FIBERS; GROUP 1A OR 2A METAL OR AMMONIUM HALIDE AS A SOLUBILITY-ENHANCING AGENT TEIJIN LIMITED (JP) 1981-02-10 US disclosed
EP-0008126-A1 Aromatic polyamide composition TEIJIN LIMITED (JP) 1980-02-20 EP disclosed