SCHEMBL20642135

SCHEMBL20642135

CC1=C(C#N)C(=O)N(N(c2ccc(C)cc2)c2ccc(C)cc2)C(=O)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ NCOA2 Q15596 1/20 0.33

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
SCHEMBL20642134 0.89 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1USP2
SCHEMBL20642139 0.78 PKM (0.37) ALDH1A1MAPTKDM4EMEN1USP2
SCHEMBL15782056 0.77 ALOX15 (0.32) MEN1GAATHRBALOX15KMT2A
SCHEMBL14937740 0.75 GAA (0.50) ALDH1A1MAPTMEN1POLBGAA
SCHEMBL20642149 0.72 ALDH1A1 (0.36) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL20642137 0.71 SLC6A2 (0.34) ALDH1A1GAATSHRHSD17B10
SCHEMBL20642151 0.70 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL20642152 0.70 MEN1 (0.36) MAPTMEN1KMT2A
SCHEMBL20642136 0.70 MAPT (0.34) MAPT
SCHEMBL20642140 0.69 ALDH1A1 (0.34) ALDH1A1MAPTKDM4EMEN1POLB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10179858-B2 Compound, ink, resist composition for color filter, thermal transfer recording sheet, and toner CANON KABUSHIKI KAISHA (JP) 2019-01-15 — — US disclosed
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