SCHEMBL5838736

SCHEMBL5838736

Cc1cccc(C)c1Nc1cccnc1Nc1c(C)cccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 2/20 0.48
▸ GAA P10253 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAPGEF4 Q8WZA2 1/20 0.44
▸ GRM5 P41594 1/20 0.44
▸ MAPT P10636 4/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ PTGS2 P35354 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ CYP3A4 P08684 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 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
SCHEMBL2283401 0.79 KDR (0.56) LMNARAB9ANPC1MAPTKMT2A
SCHEMBL5839007 0.79 SRC (0.46) SRCRAPGEF4MAPTKMT2AALDH1A1
SCHEMBL5838972 0.77 GRM5 (0.38) LMNARAB9ANPC1GRM5MAPT
SCHEMBL1921293 0.75 RAPGEF4 (0.57) RAB9ANPC1RAPGEF4MAPTKMT2A
Metanixin SCHEMBL2107737 0.75 LMNA (0.78) GAALMNARAB9ANPC1MAPT
SCHEMBL28912996 0.74 LMNA (0.50) LMNAKDM4EKMT2AALDH1A1PTGS2
SCHEMBL30462472 0.74 LMNA (0.50) LMNAKDM4EKMT2AALDH1A1PTGS2
SCHEMBL17154865 0.74 SLC2A1 (0.51) GAALMNARAB9ANPC1MAPT
SCHEMBL15368480 0.73 NPC1 (0.61) GAALMNAKDM4ERAB9ANPC1
SCHEMBL4800221 0.73 RAPGEF4 (0.55) GAARAB9ANPC1RAPGEF4MAPT

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
US-6992034-B2 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2006-01-31 — — US disclosed
US-20050009690-A1 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATIONS, U.S.A. 2005-01-13 — — US disclosed
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