SCHEMBL6615008

SCHEMBL6615008

O=C(Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccccc3Cl)n2)c1)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ MAPT P10636 4/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ RAB9A P51151 4/20 0.43
▸ CRACR2A Q9BSW2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 3/20 0.42
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ HTT P42858 2/20 0.41
▸ KCNMA1 Q12791 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ ACKR3 P25106 1/20 0.39

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
SCHEMBL6617708 0.89 ACKR3 (0.41) SMN1; SMN2MAPTKDM4ECRACR2ALMNA
SCHEMBL6617644 0.87 ACKR3 (0.40) SMN1; SMN2MAPTCRACR2AALDH1A1LMNA
SCHEMBL6619830 0.86 CRACR2A (0.46) SMN1; SMN2MAPTKDM4EL3MBTL1NPC1
SCHEMBL6618271 0.86 MAPT (0.41) SMN1; SMN2MAPTKDM4ERAB9AMEN1
SCHEMBL6616214 0.85 NAMPT (0.46) SMN1; SMN2MAPTKDM4ENPC1RAB9A
SCHEMBL6617192 0.85 MAPT (0.43) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL6660284 0.85 ACKR3 (0.42) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL6617068 0.84 PKM (0.38) SMN1; SMN2MAPTKDM4EL3MBTL1NPC1
SCHEMBL6621069 0.84 CRACR2A (0.44) SMN1; SMN2MAPTKDM4EL3MBTL1NPC1
SCHEMBL6618968 0.84 CRACR2A (0.42) SMN1; SMN2NPC1RAB9ACRACR2ALMNA

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
EP-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP disclosed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO disclosed
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