SCHEMBL9523341

SCHEMBL9523341

CCOC(=O)c1c2n(c3cc(N(C)C)c(F)cc3c1=O)C(C)S2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
ADRB2 P07550 1/20 0.32
PRKD3 O94806 1/20 0.32
PIM1 P11309 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
IRAK1 P51617 1/20 0.32
RPS6KA3 P51812 1/20 0.32
DYRK1A Q13627 1/20 0.32
PIM3 Q86V86 1/20 0.32

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
SCHEMBL1699779 0.89 LMNA (0.47) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568344 0.81 ALDH1A1 (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568297 0.81 KDM4E (0.45) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568361 0.81 LMNA (0.38) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568806 0.81 LMNA (0.41) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568347 0.80 PRKCZ (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9522285 0.80 LMNA (0.57) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9568369 0.80 LMNA (0.40) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9673380 0.80 STAT3 (0.44) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9694319 0.79 LMNA (0.49) LMNAKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249043-B1 QUINOLINECARBOXYLIC ACID DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-08-04 EP disclosed
US-4843070-A BACTERIDCIDES, FUNGICIDES NIPPON SHINYAKU CO., LTD. (JP) 1989-06-27 US disclosed
EP-0249043-A2 Quinolinecarboxylic acid derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1987-12-16 EP disclosed