SCHEMBL7466407

SCHEMBL7466407

Nc1nc(-c2ccc(NC(=O)C(Cc3ccccc3)NC(=O)O)cc2)cs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.55
KMT2A Q03164 9/20 0.55
RAB9A P51151 7/20 0.55
NPC1 O15118 5/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LTA4H P09960 1/20 0.50
ALDH1A1 P00352 6/20 0.49
MAPT P10636 5/20 0.49
LMNA P02545 2/20 0.49
GAA P10253 2/20 0.49
PKM P14618 1/20 0.49
KDM4E B2RXH2 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
GPR142 Q7Z601 1/20 0.48
PSMB8 P28062 2/20 0.48
PSMB11 A5LHX3 1/20 0.48
PSMD11 O00231 1/20 0.48
PSMD12 O00232 1/20 0.48

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
SCHEMBL7466421 1.00 MEN1 (0.55) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL18983598 0.79 SCN9A (0.53) MEN1KMT2ASMN1; SMN2MAPTPSMB8
SCHEMBL18983593 0.79 SCN9A (0.53) MEN1KMT2ASMN1; SMN2MAPTPSMB8
SCHEMBL18983568 0.75 SMN1; SMN2 (0.56) MEN1KMT2ASMN1; SMN2MAPTGAA
SCHEMBL4526386 0.75 FPR2 (0.67) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL14106361 0.75 MEN1 (0.61) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL14105824 0.75 MEN1 (0.61) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL7470299 0.74 MGLL (0.62) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL18114095 0.74 MEN1 (0.74) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL10260922 0.74 SMN1; SMN2 (0.65) SMN1; SMN2GAAGPR142PSMB8PSMB11

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 5 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