SCHEMBL9728445

SCHEMBL9728445

CCOC(=O)c1c[nH]c2c(F)c(OC3CCN(C(=O)OC(C)(C)C)C3)c(F)c(N)c2c1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PIK3CD O00329 9/20 0.37
GPR119 Q8TDV5 2/20 0.36
BTK Q06187 1/20 0.36
NPBWR1 P48145 1/20 0.35
MCHR1 Q99705 1/20 0.35
ALOX15 P16050 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 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
SCHEMBL9728493 0.83 CACNA1F (0.41) MEN1ALDH1A1LMNAGAAKMT2A
SCHEMBL9728401 0.73 CACNA1F (0.51) MEN1KMT2APOLB
SCHEMBL9728418 0.71 ADRB2 (0.53) ALDH1A1KMT2ABTKALOX15KDM4E
SCHEMBL19729369 0.69 GPR119 (0.41) PIK3CDGPR119NPBWR1MCHR1ALOX15
SCHEMBL21341518 0.67 GPR119 (0.39) MEN1ALDH1A1LMNAGAAKMT2A
SCHEMBL19729370 0.67 PIK3CD (0.45) PIK3CDGPR119NPBWR1MCHR1KDM4E
SCHEMBL1430070 0.67 GABRA1 (0.43) MEN1ALDH1A1LMNAGAAKMT2A
SCHEMBL9728544 0.67 ADRB2 (0.44) ALDH1A1LMNAKMT2APIK3CDGPR119
SCHEMBL19729367 0.67 PIK3CD (0.43) MEN1KMT2ASMN1; SMN2NPSR1PIK3CD
SCHEMBL27282789 0.66 CLEC4M (0.56) MEN1ALDH1A1KMT2ASMN1; SMN2NPSR1

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
US-5153203-A QUINOLONE DERIVATIVES AND SALTS THEREOF, PREPARATION PROCESSES THEREOF, AND ANTIBACTERIAL AGENTS CONTAINING THE SAME WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1992-10-06 US disclosed
EP-0390215-A2 Quinolone derivatives and salts thereof, preparation process es thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1990-10-03 EP disclosed