SCHEMBL27893642

SCHEMBL27893642

CCCCc1cccc(N)c1OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ PTGS2 P35354 2/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ TLR8 Q9NR97 5/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ PARP1 P09874 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ LIPG Q9Y5X9 1/20 0.35
▸ SKP2 Q13309 1/20 0.35
▸ CSNK1A1 P48729 1/20 0.35
▸ CSNK1D P48730 1/20 0.35
▸ PRKCD Q05655 1/20 0.35
▸ PAK1 Q13153 1/20 0.35
▸ CAMK2B Q13554 1/20 0.35
▸ CAMK2G Q13555 1/20 0.35
▸ CAMK2D Q13557 1/20 0.35

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
SCHEMBL27311392 0.84 ALOX5 (0.46) CYP1A2CYP2C9CYP2C19PTGS2ALOX5
SCHEMBL2211960 0.82 ALDH1A1 (0.48) CYP1A2CYP2C9CYP2C19ALDH1A1TP53
SCHEMBL31226430 0.80 ALDH1A1 (0.47) CYP1A2CYP2C9CYP2C19ALDH1A1TP53
SCHEMBL18585984 0.79 ALOX5 (0.53) CYP1A2CYP2C9CYP2C19PTGS2ALOX5
SCHEMBL6943999 0.79 ALDH1A1 (0.58) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL27519504 0.76 ALDH1A1 (0.38) ALDH1A1TP53CYP3A4
SCHEMBL659538 0.76 TLR8 (0.42) CYP1A2CYP2C9CYP2C19PTGS2ALOX5
SCHEMBL29573660 0.75 TLR8 (0.49) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL44325 0.75 TLR8 (0.49) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL6755989 0.75 PTGS2 (0.51) PTGS2ALOX5LIPGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102702012-A Method for preparing light stabilizer N-(2-ethylphenyl)-N'-(2-ethoxy-5-tert-butyl-phenyl)-diamine oxalate NANTONG HUIKANG INTERNAT ENTPR CO LTD 2012-10-03 — — CN claimed
CN-102702012-A Method for preparing light stabilizer N-(2-ethylphenyl)-N'-(2-ethoxy-5-tert-butyl-phenyl)-diamine oxalate NANTONG HUIKANG INTERNAT ENTPR CO LTD 2012-10-03 — — CN disclosed
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