SCHEMBL14048851

SCHEMBL14048851

O=c1c2ccccc2ncn1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCD O00767 4/20 0.60
SMN1; SMN2 Q16637 4/20 0.58
MAPK1 P28482 1/20 0.57
RECQL P46063 1/20 0.57
MAPK10 P53779 1/20 0.57
MAPT P10636 1/20 0.57
FSCN1 Q16658 2/20 0.56
HTT P42858 1/20 0.54
STAT3 P40763 1/20 0.53
TP53 P04637 1/20 0.53
HDAC1 Q13547 1/20 0.53

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
SCHEMBL5532025 0.86 RAB9A (0.65) SCDSMN1; SMN2MAPK1RECQLMAPK10
SCHEMBL16210930 0.84 SMN1; SMN2 (0.64) SMN1; SMN2RECQLMAPK10HTTSTAT3
SCHEMBL29692294 0.84 SMN1; SMN2 (0.64) SMN1; SMN2RECQLMAPK10HTTSTAT3
SCHEMBL2315711 0.83 SCD (0.63) SCDSMN1; SMN2MAPK1FSCN1HTT
SCHEMBL2317430 0.83 SCD (0.63) SCDSMN1; SMN2MAPK1FSCN1HTT
SCHEMBL3087107 0.83 SCD (0.63) SCDSMN1; SMN2MAPK1FSCN1HTT
SCHEMBL2312640 0.83 SCD (0.63) SCDSMN1; SMN2MAPK1FSCN1HTT
SCHEMBL17677816 0.82 GRK2 (0.64) SMN1; SMN2RECQLMAPK10HTTSTAT3
SCHEMBL5529666 0.82 SMN1; SMN2 (0.67) SMN1; SMN2RECQLMAPK10MAPTHTT
SCHEMBL2314932 0.80 SCD (0.66) SCDSMN1; SMN2MAPK1

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-1687284-B1 p-38 KINASE INHIBITORS NOVARTIS AG (CH) 2008-10-29 EP disclosed