SCHEMBL12424846

SCHEMBL12424846

COc1cc(C)ccc1C1=C2C(=O)NC(c3ccc(C)cc3OC)=C2C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.46
CHEK1 O14757 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
GSK3B P49841 3/20 0.38
PRKCA P17252 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.37
STK10 O94804 2/20 0.37
SLK Q9H2G2 2/20 0.37
USP2 O75604 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
CDK4 P11802 1/20 0.36
CCNA2 P20248 1/20 0.36
CCND1 P24385 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
ALKBH3 Q96Q83 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL12424741 0.79 GAA (0.49) GAAKMT2ACA1CA2CA4
SCHEMBL9042282 0.77 GSK3B (0.56) CHEK1GSK3BSTK10SLK
SCHEMBL9938324 0.75 ACHE (0.68) ACHEALDH1A1CYP3A4MCOLN3USP2
SCHEMBL12424844 0.73 PRMT1 (0.46) ALDH1A1GSK3BPRKCASTK10SLK
SCHEMBL9338722 0.73 CDK4 (0.47) ALDH1A1GSK3BPRKCASTK10SLK
SCHEMBL12424869 0.72 NISCH (0.41) ALDH1A1GSK3BL3MBTL1CA1CA2
SCHEMBL12424879 0.72 STK10 (0.50) GSK3BSTK10SLKCDK2KDR
SCHEMBL9339235 0.71 STK10 (0.56) CHEK1GSK3BSTK10SLK
SCHEMBL16024282 0.69 KDM4E (0.51) ALDH1A1GSK3BPRKCASTK10SLK
SCHEMBL12424899 0.69 CDK4 (0.46) CHEK1ALDH1A1GSK3BPRKCASTK10

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
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed