SCHEMBL7478638

SCHEMBL7478638

CC(C)(C)NC(=O)N(CC(=O)Nc1ccc(-c2csc(N)n2)cc1)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.50
▸ KMT2A Q03164 10/20 0.50
▸ RAB9A P51151 9/20 0.50
▸ NPC1 O15118 7/20 0.50
▸ MAPT P10636 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ GAA P10253 2/20 0.50
▸ POLB P06746 2/20 0.50
▸ LTA4H P09960 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ ROCK2 O75116 1/20 0.43
▸ ROCK1 Q13464 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ STAT1 P42224 1/20 0.41
▸ NFKB1 P19838 2/20 0.41
▸ NFKB2 Q00653 2/20 0.41
▸ RELA Q04206 2/20 0.41
▸ L3MBTL1 Q9Y468 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
SCHEMBL7463048 0.82 CYP3A4 (0.57) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7470064 0.80 CPB1 (0.48) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7637970 0.79 MEN1 (0.50) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7532393 0.78 RAB9A (0.47) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7471959 0.77 KMT2A (0.54) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7470299 0.73 MGLL (0.62) MEN1KMT2ARAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL7470042 0.72 MGLL (0.61) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL14825155 0.72 RAB9A (0.75) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7463271 0.72 RAB9A (0.60) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL27511900 0.72 MEN1 (0.56) MEN1KMT2ARAB9ANPC1MAPT

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
EP-0871619-B1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMA (US) 2002-11-06 — — EP disclosed
US-6057451-A AMINOTHIAZOLE DERIVATIVES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-05-02 — — US disclosed
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