SCHEMBL6617082

SCHEMBL6617082

Cc1cccc(CNC(=O)n2nc(-c3ccc(NC(=O)CC(C)C)cc3O)cc2C2CCCC2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ ROCK2 O75116 2/20 0.35
▸ ASAH1 Q13510 1/20 0.35
▸ DRD4 P21917 2/20 0.35

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
SCHEMBL6615563 0.98 TERT (0.36) TERTLMNAPOLBTHRBMEN1
SCHEMBL6619302 0.94 MAPK14 (0.36) TERTLMNAMEN1KMT2ANPC1
SCHEMBL6618149 0.92 MAPK14 (0.37) TERTLMNAPOLBMEN1KMT2A
SCHEMBL6616445 0.92 SMN1; SMN2 (0.41) LMNAPOLBMEN1KMT2ANPC1
SCHEMBL6617462 0.91 CNR1 (0.39) POLBMEN1KMT2ANPC1KDM4E
SCHEMBL6618080 0.91 GAA (0.37) LMNAPOLBMEN1KMT2ANPC1
SCHEMBL6617191 0.90 SMN1; SMN2 (0.41) LMNAPOLBMEN1KMT2ANPC1
SCHEMBL6677796 0.90 MAPK14 (0.37) LMNAPOLBMEN1KMT2ANPC1
SCHEMBL6616388 0.89 NAMPT (0.37) LMNAROCK2ASAH1DRD2
SCHEMBL6617523 0.88 NPSR1 (0.44) MEN1KMT2ANPC1ALDH1A1RAB9A

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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