SCHEMBL9703950

SCHEMBL9703950

CCN(CC)c1ccc(-n2nc3cccc(Cl)c3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
MAPT P10636 4/20 0.40
RAB9A P51151 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
PTGS2 P35354 1/20 0.37
PARP1 P09874 1/20 0.36
HTT P42858 2/20 0.36
KDM1A O60341 1/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
NPC1 O15118 2/20 0.35
HSD17B10 Q99714 2/20 0.35
GHSR Q92847 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TSHR P16473 2/20 0.34

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
SCHEMBL9655586 0.82 HPGD (0.53) ALOX5MAPTRAB9AMEN1KMT2A
SCHEMBL10825713 0.77 KDM4E (0.61) ALOX5MAPTRAB9AMEN1KMT2A
SCHEMBL10999725 0.74 NPC1 (0.51) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL10999006 0.73 TERT (0.51) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL11111830 0.72 ALDH1A1 (0.46) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL24458194 0.71 MAPT (0.55) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL10664565 0.70 PTGS2 (0.36) ALOX5MAPTRAB9AMEN1KMT2A
SCHEMBL9151664 0.70 ALDH1A1 (0.36) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL3422262 0.70 NPC1 (0.53) MAPTRAB9AMEN1KMT2AGAA
SCHEMBL9655378 0.69 MEN1 (0.46) MAPTRAB9AMEN1KMT2AGAA

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
EP-0476519-A1 Photopolymerisable composition and recording material produced therefrom MORTON INTERNATIONAL, INC. (US) 1992-03-25 EP disclosed