SCHEMBL9030940

SCHEMBL9030940

CCOC(=O)c1cn(N(C)C(=O)OC(C)(C)C)c2c(F)c(F)c(F)c(F)c2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.57
HTT P42858 2/20 0.51
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP1A2 P05177 1/20 0.39
HSD17B10 Q99714 3/20 0.35
NPC1 O15118 1/20 0.35
MITF O75030 1/20 0.35
TP53 P04637 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ADRB2 P07550 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
KMT2A Q03164 1/20 0.34
GNRHR P30968 2/20 0.34

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
SCHEMBL9427196 0.85 STAT3 (0.52) STAT3HTTKDM4EALDH1A1HSD17B10
SCHEMBL9031356 0.84 STAT3 (0.53) STAT3HTTTSHRCASP1KDM4E
SCHEMBL3290751 0.79 STAT3 (0.41) STAT3HTTKDM4EALDH1A1CYP1A2
SCHEMBL27287068 0.74 STAT3 (0.70) STAT3HTTTSHRCASP1KDM4E
SCHEMBL9427167 0.73 STAT3 (0.38) STAT3HTTKDM4EALDH1A1RECQL
SCHEMBL9030909 0.72 STAT3 (0.67) STAT3HTTTSHRCASP1KDM4E
SCHEMBL13326854 0.72 STAT3 (0.48) STAT3HTTKDM4EALDH1A1HSD17B10
SCHEMBL10899205 0.72 KDM4E (0.44) STAT3KDM4EALDH1A1CYP1A2HSD17B10
SCHEMBL23646765 0.71 LMNA (0.44) TSHRKDM4EALDH1A1CYP1A2HSD17B10
SCHEMBL1345146 0.71 STAT3 (0.65) STAT3HTTTSHRCASP1KDM4E

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-0470578-B1 Novel tricyclic compound or salts thereof, method for producing the same and antimicrobial agent containing the same WAKUNAGA SEIYAKU KK (JP) 1996-11-06 EP disclosed
US-5399553-A Oral absorbability WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1995-03-21 US disclosed
US-5359066-A Certain tricyclic pyrido[3,2,1-ij]cinnoline-8-carboxylates, useful as antimicrobial agents WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1994-10-25 US disclosed
US-5254685-A Tricyclic compound or salts thereof, method for producing the same and antimicrobial agent containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1993-10-19 US disclosed
EP-0530368-A1 PROCESS FOR PRODUCING TRICYCLIC COMPOUND OR SALT THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-03-10 EP disclosed
CN-1059144-A New tricyclic compound or its salt, prepare their method and contain their antiseptic-germicide WAKUNAGA SEIYAKU KK (JP) 1992-03-04 CN disclosed
EP-0470578-A1 Novel tricyclic compound or salts thereof, method for producing the same and antimicrobial agent containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1992-02-12 EP disclosed