SCHEMBL6618827

SCHEMBL6618827

Cc1cccc(CNC(=O)n2nc(-c3cc(NC(=O)c4cccnc4Cl)ccc3O)cc2C2CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 2/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ PPARG P37231 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ IKBKB O14920 1/20 0.35
▸ CRACR2A Q9BSW2 1/20 0.35
▸ HTT P42858 1/20 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
SCHEMBL6613151 0.93 ALDH1A1 (0.41) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6603258 0.88 ALDH1A1 (0.44) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6614830 0.88 MAPT (0.41) ALDH1A1MEN1KMT2ARAB9APPARG
SCHEMBL6615270 0.87 CRACR2A (0.44) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6616412 0.87 MAPT (0.41) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6616089 0.86 ALDH1A1 (0.43) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6619099 0.86 KCNK3 (0.43) ACKR3MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6615419 0.86 MAPT (0.40) ACKR3ALDH1A1MEN1KMT2ARAB9A
SCHEMBL6616130 0.85 ASAH1 (0.38) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL6618968 0.85 CRACR2A (0.42) ACKR3RAB9ANPC1SMN1; SMN2LMNA

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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