SCHEMBL23320474

SCHEMBL23320474

CC(c1ccncc1)N(C(N)=O)c1ccc2c(c1)cc(-c1cccc(S(C)(=O)=O)c1)n2C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES2 Q9H7Z7 1/20 0.36
▸ LARS1 Q9P2J5 1/20 0.36
▸ PDE4A P27815 4/20 0.34
▸ PDE4B Q07343 4/20 0.34
▸ PDE4C Q08493 4/20 0.34
▸ PDE4D Q08499 4/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ GRM2 Q14416 1/20 0.34
▸ LRRK2 Q5S007 2/20 0.33
▸ CSNK2A2 P19784 1/20 0.33
▸ CSNK2B P67870 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ MET P08581 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ MAP2K2 P36507 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ MAPK8 P45983 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ NTRK3 Q16288 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
SCHEMBL23320473 0.87 CYP19A1 (0.41) ALOX5
SCHEMBL23320543 0.82 PTGES2 (0.36) PTGES2KCNH2GRM2LRRK2CSNK2A2
SCHEMBL23320490 0.81 ALOX5 (0.38) NTRK1ALOX5
SCHEMBL23320476 0.81 PTGES2 (0.35) PTGES2KCNH2GRM2LRRK2CSNK2A2
SCHEMBL23320489 0.80 CHEK1 (0.37) GSK3B
SCHEMBL23320491 0.76 ALDH1A1 (0.38) —
SCHEMBL30943322 0.71 PTGES2 (0.47) PTGES2KCNH2GRM2NR1H2LOXL2
SCHEMBL23320518 0.71 PTGES2 (0.47) PTGES2KCNH2GRM2NR1H2LOXL2
SCHEMBL24042576 0.70 NAMPT (0.51) —
SCHEMBL30943169 0.70 NAMPT (0.51) —

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-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 — — EP disclosed
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