SCHEMBL11716003

SCHEMBL11716003

CCOc1c(NC)c2c(c3ccccc13)C(=O)NC2=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 4/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ GSK3B P49841 3/20 0.36
▸ CDK4 P11802 2/20 0.36
▸ CCND1 P24385 2/20 0.36
▸ GSK3A P49840 2/20 0.36
▸ CDK5 Q00535 2/20 0.36
▸ CDK5R1 Q15078 2/20 0.36
▸ CHEK1 O14757 1/20 0.36
▸ WEE1 P30291 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ ELANE P08246 1/20 0.35
▸ GUSB P08236 2/20 0.33
▸ SLC2A1 P11166 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
SCHEMBL11712853 0.89 PTGER4 (0.37) PTGER4GSK3BCDK4CCND1GSK3A
SCHEMBL11712173 0.88 NCF1 (0.34) PTGER4CYP1A2CYP2D6GSK3BCDK4
SCHEMBL11722544 0.88 PTGER4 (0.38) PTGER4GSK3BCDK4CCND1GSK3A
SCHEMBL11712259 0.87 PTGER4 (0.38) PTGER4CYP1A2CYP2D6GSK3BCDK4
SCHEMBL11717020 0.85 KDM4E (0.39) PTGER4CYP1A2CYP2D6GSK3BCDK4
SCHEMBL11709013 0.85 ALDH1A1 (0.46) GSK3BCHEK1GAAMEN1KMT2A
SCHEMBL11713383 0.85 GSK3B (0.36) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11715487 0.85 GSK3B (0.36) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11712283 0.85 CDK4 (0.40) GSK3BCDK4CCND1GSK3ACDK5
SCHEMBL11717134 0.84 KDM4E (0.43) CYP1A2GSK3BCDK4CCND1GSK3A

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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