SCHEMBL8057745

SCHEMBL8057745

Cc1nc(-c2cccc(NC(N)=O)c2)cs1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.68
LMNA P02545 3/20 0.67
HTT P42858 5/20 0.62
BRD4 O60885 1/20 0.58
ALDH1A1 P00352 2/20 0.57
TSHR P16473 1/20 0.57
RECQL P46063 1/20 0.57
HPGD P15428 1/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
NFKB1 P19838 3/20 0.57
NFKB2 Q00653 3/20 0.57
RELA Q04206 3/20 0.57
MAPK1 P28482 2/20 0.57
KDM4E B2RXH2 1/20 0.57
POLB P06746 1/20 0.57
CYP1A2 P05177 1/20 0.54

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
SCHEMBL1764786 0.88 MAPT (0.70) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL19627035 0.83 RAB9A (0.70) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL14640404 0.81 MAPT (0.61) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL4455272 0.80 LMNA (0.65) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL3088586 0.80 RECQL (0.63) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL3140270 0.80 SMN1; SMN2 (0.65) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL2739995 0.79 MAPT (0.65) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL10061659 0.78 MAPT (0.64) MAPTLMNAHTTBRD4ALDH1A1
SCHEMBL2229720 0.78 MAPT (0.63) MAPTLMNAHTTBRD4MEN1
SCHEMBL2739994 0.78 MAPT (0.63) MAPTLMNAHTTBRD4ALDH1A1

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
WO-2009090548-A2 3-AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-07-23 WO disclosed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 WO disclosed