SCHEMBL9779963

SCHEMBL9779963

Cc1ccc(N2CC(=O)N(C)C(=O)N2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.40
F2 P00734 1/20 0.39
ELANE P08246 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
CTRC Q99895 1/20 0.39
MGLL Q99685 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MMP2 P08253 1/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36
ADRB1 P08588 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
RGS4 P49798 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
SCHEMBL9779995 0.84 MEN1 (0.39) ALOX5MAPTLMNAMGLLHTT
SCHEMBL9779986 0.84 G6PD (0.47) ALOX5GSK3AGSK3B
SCHEMBL9780043 0.81 ALDH1A1 (0.42) MAPTLMNACTSGCMA1HTT
SCHEMBL9780007 0.81 POLB (0.49) MAPTLMNAMGLLHTTSMN1; SMN2
SCHEMBL9780008 0.80 ALOX5 (0.55) ALOX5MAPTLMNAMGLLADRB1
SCHEMBL9779997 0.77 BPTF (0.38) ALOX5MMP2POLB
SCHEMBL9780037 0.74 ALOX5 (0.46) ALOX5MAPTPOLB
SCHEMBL9779956 0.73 ALOX5 (0.53) ALOX5MAPTMGLLHTTADRB1
SCHEMBL9779943 0.73 NPC1 (0.49) ALOX5LMNASMN1; SMN2MMP2NPC1
SCHEMBL9780035 0.72 ALOX5 (0.53) ALOX5MAPTELANEMGLLSMN1; SMN2

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-4985427-A LIPOXYGENASE INHIBITORS GLAXO GROUP LIMITED (GB) 1991-01-15 US disclosed
EP-0340030-A2 Triazine derivatives GLAXO GROUP LIMITED (GB) 1989-11-02 EP disclosed