SCHEMBL6617188

SCHEMBL6617188

O=C(Nc1ccc(O)c(-c2cc(C3CCC3)n(C(=O)NCc3ccccc3F)n2)c1)c1ccco1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 5/20 0.41
▸ PKM P14618 1/20 0.39
▸ NPC1 O15118 7/20 0.39
▸ SMN1; SMN2 Q16637 5/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ TP53 P04637 4/20 0.37
▸ MAPK1 P28482 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ BCHE P06276 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA2B P29275 1/20 0.36

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
SCHEMBL6619863 0.97 RAB9A (0.43) RAB9AALDH1A1MAPTPKMNPC1
SCHEMBL6618131 0.89 MAPT (0.45) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL6617223 0.89 MAPT (0.40) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL6614679 0.88 MAPT (0.42) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL6647398 0.87 KMT2A (0.38) RAB9AMAPTKDM4EMEN1KMT2A
SCHEMBL6603282 0.86 CRACR2A (0.45) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL6651951 0.86 P2RY14 (0.41) MAPTSMN1; SMN2LMNAMAPK14HPGD
SCHEMBL6622320 0.85 MAPT (0.42) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL6618868 0.85 RAB9A (0.45) RAB9AALDH1A1MAPTPKMNPC1
SCHEMBL6615996 0.85 HPGD (0.50) RAB9AALDH1A1MAPTPKMNPC1

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 claimed
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 claimed
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