SCHEMBL8985137

SCHEMBL8985137

N#CNC1(NC#N)C=CC(C(=O)c2ccccc2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 5/20 0.35
ALOX15 P16050 3/20 0.35
HTT P42858 3/20 0.35
HBB P68871 1/20 0.35
EPHX1 P07099 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
CES1 P23141 2/20 0.33
MEN1 O00255 2/20 0.33
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 2/20 0.33
CTSL P07711 2/20 0.33
CTSB P07858 2/20 0.33
CTSK P43235 2/20 0.33
POLB P06746 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
SCHEMBL5435457 0.80 ALDH1A1 (0.38) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL8985174 0.78 MEN1 (0.41) ALDH1A1MAPTEPHX1SMN1; SMN2MEN1
SCHEMBL337965 0.78 TSHR (0.38) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL17042559 0.76 ALDH1A1 (0.36) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL136598 0.75 MAPT (0.41) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL811694 0.74 CES1 (0.41) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL993045 0.74 CES1 (0.45) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL156512 0.74 MAPT (0.40) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL363122 0.74 MAPT (0.40) ALDH1A1MAPTALOX15HTTHBB
SCHEMBL528381 0.74 MAPT (0.40) ALDH1A1MAPTALOX15HTTHBB

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
EP-0476589-B1 Multi-layer wiring substrate and production thereof HITACHI LTD (JP) 1996-06-12 EP disclosed
EP-0476589-A2 Multi-layer wiring substrate and production thereof HITACHI, LTD. (JP) 1992-03-25 EP disclosed