SCHEMBL11713363

SCHEMBL11713363

COc1ccccc1C(=O)NN1C(=O)c2cc(Cl)c3ccccc3c2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 3/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ CYP1A2 P05177 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ BLM P54132 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ CTSD P07339 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ KCNK3 O14649 1/20 0.41
▸ KCNK9 Q9NPC2 1/20 0.41
▸ KCNMA1 Q12791 1/20 0.41

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
SCHEMBL25210751 0.80 PTGS1 (0.63) CYP3A4ALDH1A1POLBNPC1KMT2A
SCHEMBL11713369 0.80 KMT2A (0.60) CYP3A4ALDH1A1POLBNPC1CYP1A2
SCHEMBL11720157 0.74 GAA (0.44) ALDH1A1NPC1KMT2AMEN1TDP1
SCHEMBL11817513 0.72 PTGS1 (0.67) CYP3A4ALDH1A1POLBNPC1KMT2A
SCHEMBL11808261 0.71 PTGS1 (0.69) CYP3A4ALDH1A1POLBNPC1TSHR
SCHEMBL11812310 0.70 PTGS1 (0.56) CYP3A4ALDH1A1POLBNPC1KMT2A
SCHEMBL11811601 0.70 PTGS1 (0.62) CYP3A4ALDH1A1POLBNPC1TSHR
SCHEMBL11808596 0.69 PTGS1 (0.75) ALDH1A1NPC1KMT2AMEN1PTGS1
SCHEMBL11808813 0.69 PTGS1 (0.61) CYP3A4ALDH1A1POLBNPC1CYP1A2
SCHEMBL11806443 0.69 PTGS1 (0.61) CYP3A4ALDH1A1POLBNPC1TSHR

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
Send feedback