SCHEMBL6615291

SCHEMBL6615291

C=CCn1nc(-c2cc(NC(=O)c3ccco3)ccc2O)cc1C1CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.46
▸ RAB9A P51151 11/20 0.43
▸ NPC1 O15118 11/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ SIRT6 Q8N6T7 2/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ SMN1; SMN2 Q16637 7/20 0.41
▸ TP53 P04637 5/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ SIRT3 Q9NTG7 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL6618509 0.96 MAPT (0.44) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6617830 0.91 RAB9A (0.43) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6621939 0.88 MAPT (0.48) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6615538 0.88 RAB9A (0.48) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6619931 0.86 MAPT (0.46) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6617632 0.85 MAPT (0.47) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6616979 0.84 RAB9A (0.47) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6614347 0.84 KDM5A (0.43) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6616989 0.82 MAPT (0.43) MAPTRAB9ANPC1ALDH1A1SIRT6
SCHEMBL6620548 0.82 ALDH1A1 (0.40) MAPTRAB9ANPC1ALDH1A1MEN1

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 4 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
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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