SCHEMBL7014972

SCHEMBL7014972

CCOC(=O)c1cn(-c2c(F)cc(F)cc2NC(=O)OCc2ccccc2)c2cc(F)c(F)c(C)c2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.41
HTT P42858 2/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PIM1 P11309 1/20 0.36
IRAK1 P51617 1/20 0.36
CAMK2B Q13554 1/20 0.36
CAMK2G Q13555 1/20 0.36
CAMK2D Q13557 1/20 0.36
PIM3 Q86V86 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
TP53 P04637 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MGAT2 Q10469 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
GNRHR P30968 3/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL7005460 0.86 PIM1 (0.41) STAT3HTTNPC1RAB9APIM1
SCHEMBL7010692 0.76 PIM1 (0.40) STAT3HTTPIM1IRAK1CAMK2B
SCHEMBL8102928 0.75 HTT (0.50) STAT3HTTPIM1IRAK1CAMK2B
SCHEMBL8112568 0.74 HTT (0.57) STAT3HTTNPC1RAB9ATP53
SCHEMBL7005450 0.72 STAT3 (0.48) STAT3HTTNPC1RAB9APIM1
SCHEMBL7012730 0.72 HTT (0.47) STAT3HTTNPC1RAB9APIM1
SCHEMBL7005366 0.70 HTT (0.40) STAT3HTTNPC1RAB9APIM1
SCHEMBL7008093 0.69 STAT3 (0.48) STAT3HTTNPC1RAB9APIM1
SCHEMBL7004207 0.69 STAT3 (0.43) STAT3HTTNPC1RAB9APIM1
SCHEMBL8112020 0.69 KDM4E (0.54) STAT3HTTTDP1POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787720-B1 PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KK (JP) 2003-07-16 EP disclosed
EP-0787720-A1 NOVEL PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1997-08-06 EP disclosed