SCHEMBL7474863

SCHEMBL7474863

CC(=O)c1ccc(N(C)C(=O)CN(Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ESR1 P03372 1/20 0.45
POLB P06746 1/20 0.45
NR4A1 P22736 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
MAOB P27338 1/20 0.42
SRD5A1 P18405 1/20 0.42
PYCR1 P32322 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
SCHEMBL10972849 0.76 LMNA (0.59) KMT2AMEN1LMNAALDH1A1NPC1
SCHEMBL7472989 0.75 ALDH1A1 (0.62) LMNAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7474859 0.74 HDAC1 (0.61) LMNAALDH1A1NPC1RAB9A
SCHEMBL11243114 0.73 TSHR (0.53) KMT2AMEN1LMNAALDH1A1NPC1
SCHEMBL1197787 0.73 RAB9A (0.54) KMT2AMEN1LMNAALDH1A1NPC1
SCHEMBL22575409 0.72 HTT (0.70) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6495044 0.72 MAPT (0.59) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL3156563 0.71 PPIB (0.50) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL1819075 0.71 KMT2A (0.54) KMT2AMEN1ALDH1A1ESR1POLB
SCHEMBL27268123 0.71 HSD17B10 (0.49) KMT2AMEN1LMNANPC1RAB9A

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