SCHEMBL6201203

SCHEMBL6201203

O=C(O)c1cnc2c(F)c(F)c(F)cc2c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.41
ASPH Q12797 3/20 0.41
KDM8 Q8N371 2/20 0.41
ALB P02768 1/20 0.36
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
THRB P10828 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
ALOX12 P18054 1/20 0.34
ATIC P31939 1/20 0.34
EGLN1 Q9GZT9 2/20 0.34
HAVCR2 Q8TDQ0 1/20 0.34
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33

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
SCHEMBL6199950 0.81 KDM4E (0.41) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL6201208 0.81 ALB (0.40) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL538577 0.80 KMT2A (0.46) KDM4EALDH1A1MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL6083555 0.79 KDM4E (0.40) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL27471079 0.78 TET2 (0.40) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL6197857 0.78 KDM4E (0.39) KDM4EASPHKDM8GABRPGABRD
SCHEMBL6199948 0.77 ASPH (0.41) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL6197961 0.77 KDM4E (0.43) KDM4EASPHKDM8ALBAKR1C2
SCHEMBL21836559 0.76 ALOX5AP (0.39) KDM4EASPHKDM8AKR1C2HPGD
SCHEMBL15054611 0.75 KDM4E (0.41) KDM4EASPHKDM8ALBAKR1C2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP disclosed
EP-1042295-A1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-10-11 EP disclosed
US-6093732-A PREVENT HERPESVIRAL INFECTIONS, PARTICULARLY, HUMAN CYTOMEGALOVIRAL INFECTION PHARMACIA & UPJOHN COMPANY (US) 2000-07-25 US disclosed
WO-1999032450-A1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-01 WO disclosed