SCHEMBL27771292

SCHEMBL27771292

CC(C)Oc1ccc(OCc2ccc(Cl)cc2)cc1C(=O)Nc1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SGMS2 Q8NHU3 1/20 0.52
▸ PTGER1 P34995 1/20 0.49
▸ KCNMA1 Q12791 1/20 0.48
▸ MET P08581 1/20 0.48
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ LRRK2 Q5S007 2/20 0.47
▸ MAOA P21397 2/20 0.47
▸ MAOB P27338 2/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ HMOX1 P09601 1/20 0.45

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
SCHEMBL27771254 0.80 SGMS2 (0.56) SGMS2PTGER1METKMT2AALDH1A1
SCHEMBL27792486 0.78 MAOB (0.55) MAOAMAOBKDM4ENPC1RAB9A
SCHEMBL27792371 0.76 ALDH1A1 (0.60) SGMS2METKMT2AALDH1A1LMNA
SCHEMBL27792464 0.75 KCNMA1 (0.55) KCNMA1KMT2AALDH1A1LMNAMAOA
SCHEMBL27792361 0.75 KCNMA1 (0.66) SGMS2KCNMA1METKMT2AALDH1A1
SCHEMBL710194 0.74 MAOB (0.57) KMT2AALDH1A1LMNAMAOBMEN1
SCHEMBL1647532 0.70 LRRK2 (0.78) SGMS2METALDH1A1LMNALRRK2
SCHEMBL11720308 0.70 KDM4E (0.64) SGMS2KMT2AALDH1A1LMNAMEN1
SCHEMBL17551827 0.69 SGMS2 (1.00) SGMS2METKMT2AALDH1A1LMNA
SCHEMBL30322922 0.69 SGMS2 (1.00) SGMS2METKMT2AALDH1A1LMNA

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-101648919-A 3-substituted salicylamide compound, preparation method, medicinal composition and application thereof INST MATERIA MEDICA CAMS 2010-02-17 — — CN claimed
CN-101648919-A 3-substituted salicylamide compound, preparation method, medicinal composition and application thereof INST MATERIA MEDICA CAMS 2010-02-17 — — CN disclosed
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