SCHEMBL7471959

SCHEMBL7471959

CN(C)c1nc(-c2ccc(NC(=O)CN(Cc3ccccc3)C(=O)O)cc2)cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.54
▸ MEN1 O00255 9/20 0.54
▸ RAB9A P51151 6/20 0.54
▸ NPC1 O15118 5/20 0.54
▸ MAPT P10636 3/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ ROCK2 O75116 1/20 0.47
▸ ROCK1 Q13464 1/20 0.47
▸ GSTO1 P78417 1/20 0.47
▸ GRM1 Q13255 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ CPB1 P15086 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.44
▸ NFKB1 P19838 1/20 0.44

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
SCHEMBL7478638 0.77 MEN1 (0.50) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL23460215 0.77 KMT2A (0.50) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL7463048 0.76 CYP3A4 (0.57) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL7470064 0.74 CPB1 (0.48) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL7532393 0.73 RAB9A (0.47) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL7472989 0.72 ALDH1A1 (0.62) RAB9ANPC1MAPTALDH1A1LMNA
SCHEMBL21834634 0.71 MAPT (0.50) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL9481963 0.71 RAB9A (0.62) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL1474111 0.69 RAB9A (0.63) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL18674599 0.69 KMT2A (0.64) KMT2AMEN1RAB9ANPC1MAPT

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 7 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-6458959-B1 VIRICIDES AND ENZYME INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2002-10-01 — — US disclosed
US-6348477-B1 SUBSTITUTED PHENYL THIAZOLE DERIVATIVES AS VIRICIDES BOEHRINGER INGELHEIM(CANADA) LTD. (CA) 2002-02-19 — — US disclosed
US-6288091-B1 COMPOUNDS SUCH AS 2,2,2-TRICHLOROETHYL N-(4-(2-AMINO-4-THIAZOLYL)-PHENYL)CARBAMATE THAT INHIBIT THE HERPES HELCASE-PRIMASE ENZYME COMPLEX BOEHRINGER INGELHEIM LTD. (CA) 2001-09-11 — — US disclosed
US-6057451-A AMINOTHIAZOLE DERIVATIVES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-05-02 — — US disclosed
EP-0871619-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1998-10-21 — — EP disclosed
WO-1997024343-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1997-07-10 — — WO disclosed
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