SCHEMBL7469457

SCHEMBL7469457

NC(=O)[N]c1ccc(-c2cscn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 1/20 0.46
▸ PARP1 P09874 1/20 0.45
▸ SYK P43405 2/20 0.40
▸ KDM4A O75164 1/20 0.39
▸ KDM4B O94953 1/20 0.39
▸ KDM5C P41229 1/20 0.39
▸ KDM5B Q9UGL1 1/20 0.39
▸ ESR1 P03372 1/20 0.36
▸ NOS1 P29475 1/20 0.35
▸ KAT6A Q92794 1/20 0.34
▸ ATR Q13535 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.32
▸ P2RX3 P56373 2/20 0.32
▸ CARM1 Q86X55 1/20 0.32
▸ PRMT1 Q99873 1/20 0.32
▸ IDO1 P14902 1/20 0.31
▸ TDO2 P48775 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL7464854 0.78 CHEK2 (0.68) CHEK2PARP1SYKKDM4AKDM4B
SCHEMBL7469465 0.74 KIF11 (0.49) CHEK2PARP1SYKLMNAPOLB
Oxamate SCHEMBL9830672 0.73 KAT6A (0.47) CHEK2PARP1SYKKDM4AKDM4B
SCHEMBL600911 0.73 KDM4A (0.58) CHEK2PARP1KDM4AKDM4BKDM5C
SCHEMBL7464845 0.71 CHEK2 (0.49) CHEK2PARP1SYKKDM4AKDM4B
SCHEMBL6512655 0.71 CHEK2 (0.49) CHEK2PARP1KDM4AKDM4BKDM5C
SCHEMBL3245236 0.71 CHEK2 (0.41) CHEK2PARP1SYKKDM4AKDM4B
SCHEMBL1353491 0.71 METAP2 (0.46) CHEK2PARP1KDM4AKDM4BKDM5C
SCHEMBL496710 0.71 LTA4H (0.47) CHEK2PARP1KDM4AKDM4BKDM5C
Oxamate SCHEMBL9829051 0.70 MEN1 (0.48) CHEK2PARP1KDM4EPOLB

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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