SCHEMBL7465015

SCHEMBL7465015

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.56
ALDH1A1 P00352 7/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
MAPT P10636 4/20 0.56
POLB P06746 2/20 0.56
GAA P10253 2/20 0.56
NPC1 O15118 7/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
GFER P55789 2/20 0.51
KDM4E B2RXH2 1/20 0.47
MAPKAPK2 P49137 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
LTA4H P09960 2/20 0.44
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
LMNA P02545 2/20 0.44
TP53 P04637 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
SCHEMBL7462528 0.81 RAB9A (0.53) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL7125440 0.79 SREBF2 (0.58) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL126387 0.77 KMT2A (0.66) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL6810771 0.77 SMN1; SMN2 (0.60) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL14825155 0.77 RAB9A (0.75) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL5780078 0.77 KMT2A (0.60) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL8320737 0.75 RAB9A (0.59) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL11117694 0.73 SMN1; SMN2 (0.47) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL10192028 0.72 SMN1; SMN2 (0.61) RAB9AALDH1A1MAPTPOLBNPC1
SCHEMBL2322638 0.72 SMN1; SMN2 (0.61) RAB9AALDH1A1MAPTNPC1SMN1; SMN2

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 8 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
CN-1207094-A Phenyl thiazole derivatives with anti herpes virus properties BOEHRINGER INGELHEIM PHARMA (US) 1999-02-03 CN 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