SCHEMBL7733878

SCHEMBL7733878

O=C(O)CCc1cc(Cl)cc2nc(Cc3ccccc3F)oc12

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.43
NPC1 O15118 7/20 0.43
PKM P14618 2/20 0.43
RXRA P19793 7/20 0.42
RXRB P28702 7/20 0.42
RXRG P48443 7/20 0.42
AKR1B1 P15121 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
NR4A2 P43354 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL7734862 0.86 SLC22A12 (0.41) RXRARXRBRXRGAKR1B1FFAR1
SCHEMBL7734231 0.84 RAB9A (0.40) RAB9ANPC1PKMPOLB
SCHEMBL7734340 0.79 ATM (0.41) RXRARXRBRXRGAKR1B1NR4A2
SCHEMBL7733868 0.74 RXRA (0.46) RAB9ANPC1RXRARXRBRXRG
SCHEMBL7734791 0.74 RAB9A (0.39) RAB9ANPC1PKMAKR1B1POLB
SCHEMBL7734337 0.73 NLRP3 (0.36) AKR1B1
SCHEMBL7733875 0.71 LMNA (0.41) AKR1B1POLB
SCHEMBL7734700 0.71 NLRP3 (0.35) AKR1B1
SCHEMBL7735189 0.71 GAA (0.36) RAB9ANPC1POLB
SCHEMBL29444401 0.69 MEN1 (0.59) FFAR1FFAR4

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
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed
EP-0785927-A4 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 1997-12-29 EP disclosed
EP-0785927-A1 NOVEL BENZOXAZOLES Euroceltique S.A. (LU) 1997-07-30 EP disclosed
WO-1996011917-A1 NOVEL BENZOXAZOLES EURO-CELTIQUE, S.A. (LU) 1996-04-25 WO disclosed