SCHEMBL4791809

SCHEMBL4791809

CS(=O)(=O)Cc1cccc2nc(N)c3nc4n(c3c12)CCOC4

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
ALDH1A1 P00352 1/20 0.39
PIK3CB P42338 1/20 0.35
MAPK1 P28482 2/20 0.34
TP53 P04637 6/20 0.34
MAPT P10636 4/20 0.34
LMNA P02545 4/20 0.33
ATR Q13535 1/20 0.33
ATRIP Q8WXE1 1/20 0.33
GRM5 P41594 1/20 0.32
MTOR P42345 1/20 0.32
ELANE P08246 1/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
DCPS Q96C86 1/20 0.31

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
SCHEMBL2513546 0.86 LMNA (0.33) POLBALDH1A1MAPK1TP53MAPT
SCHEMBL4792173 0.85 TP53 (0.34) POLBALDH1A1MAPK1TP53MAPT
SCHEMBL4794357 0.84 PIK3CB (0.33) POLBALDH1A1PIK3CBTP53MAPT
SCHEMBL4792910 0.82 TLR8 (0.37) TP53MAPTLMNAGRM5DCPS
SCHEMBL1775006 0.82 MAPT (0.36) ALDH1A1MAPK1TP53MAPTLMNA
SCHEMBL4702114 0.82 ACHE (0.38) POLBALDH1A1TP53MAPTMTOR
SCHEMBL4707903 0.80 TLR7 (0.37) ALDH1A1TP53MAPTLMNA
SCHEMBL1776124 0.79 GRM5 (0.36) ALDH1A1TP53MAPTLMNAGRM5
SCHEMBL2241078 0.79 ALDH1A1 (0.35) POLBALDH1A1MAPK1TP53MAPT
SCHEMBL2243546 0.77 DHFR (0.33) POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831221-A4 SUBSTITUTED CHIRAL FUSED 1,2 IMIDAZO 4,5-C RING COMPOUNDS 3M INNOVATIVE PROPERTIES CO (US) 2008-11-05 EP disclosed
EP-1831221-A2 SUBSTITUTED CHIRAL FUSED 1,2 IMIDAZO 4,5-C RING COMPOUNDS 3M Innovative Properties Company (US) 2007-09-12 EP disclosed
WO-2006083440-A2 SUBSTITUTED CHIRAL FUSED [1,2]IMIDAZO[4,5-C] RING COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-10 WO disclosed