SCHEMBL11712173

SCHEMBL11712173

CCOCCOc1c(NC)c2c(c3ccccc13)C(=O)NC2=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 1/20 0.34
▸ GSK3B P49841 3/20 0.33
▸ CDK4 P11802 2/20 0.33
▸ CCND1 P24385 2/20 0.33
▸ GSK3A P49840 2/20 0.33
▸ CDK5 Q00535 2/20 0.33
▸ CDK5R1 Q15078 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CHEK1 O14757 1/20 0.31
▸ WEE1 P30291 1/20 0.31
▸ UTS2R Q9UKP6 1/20 0.31
▸ PDE3B Q13370 1/20 0.31
▸ PDE3A Q14432 1/20 0.31
▸ P2RY12 Q9H244 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31

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
SCHEMBL11713977 0.89 METAP2 (0.36) GSK3BL3MBTL1PTGER4MAPTMEN1
SCHEMBL11712853 0.88 PTGER4 (0.37) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11716003 0.88 PTGER4 (0.39) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11722544 0.87 PTGER4 (0.38) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11713383 0.87 GSK3B (0.36) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11715487 0.85 GSK3B (0.36) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11709013 0.80 ALDH1A1 (0.46) GSK3BCHEK1MEN1KMT2A
SCHEMBL11712283 0.80 CDK4 (0.40) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11718278 0.79 ALDH1A1 (0.35) GSK3BCDK4CCND1L3MBTL1PTGER4
SCHEMBL11717134 0.78 KDM4E (0.43) GSK3BCDK4CCND1GSK3ACDK5

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-4055565-A Optical brightening agents of naphthalimide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-10-25 — — US disclosed
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