SCHEMBL6201586

SCHEMBL6201586

Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(-c2n[nH]cc2-c2nc3ncccc3o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 5/20 0.53
PTGS2 P35354 6/20 0.52
MAPT P10636 2/20 0.52
TP53 P04637 1/20 0.52
LMNA P02545 3/20 0.51
HPGD P15428 3/20 0.51
ATM Q13315 2/20 0.51
HTT P42858 1/20 0.51
POLB P06746 2/20 0.49
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 4/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TYMS P04818 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
USP2 O75604 2/20 0.46
GAA P10253 2/20 0.46
HSD17B10 Q99714 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL6086038 0.85 GLA (0.53) GLAPTGS2MAPTTP53LMNA
SCHEMBL6203401 0.73 MAPT (0.54) MAPTTP53POLBKDM4EALDH1A1
SCHEMBL6201345 0.73 RAB9A (0.60) MAPTTP53HPGDPOLBKDM4E
SCHEMBL6204336 0.71 RAB9A (0.55) MAPTTP53LMNAHPGDPOLB
SCHEMBL6204331 0.70 RAB9A (0.59) MAPTTP53LMNAHPGDPOLB
SCHEMBL6085407 0.70 NPC1 (0.51) MAPTTP53LMNAHPGDPOLB
SCHEMBL6198138 0.69 MAPT (0.56) MAPTTP53LMNAHPGDPOLB
SCHEMBL6085175 0.69 CETP (0.47) MAPTTP53LMNAHPGDATM
SCHEMBL3634973 0.69 GHSR (0.88) GLAMAPTTP53LMNAHPGD
SCHEMBL6201851 0.68 RAB9A (0.54) MAPTTP53LMNAHPGDHTT

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-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed