SCHEMBL9523937

SCHEMBL9523937

CCOC(=O)c1c2n(c3cc(N4CCNC(C)C4)c(F)cc3c1=O)C(c1ccc(Cl)cc1)S2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.39
HPGD P15428 7/20 0.39
ALDH1A1 P00352 6/20 0.39
HSD17B10 Q99714 6/20 0.39
LMNA P02545 2/20 0.39
PRKD3 O94806 1/20 0.39
PIM1 P11309 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
IRAK1 P51617 1/20 0.39
RPS6KA3 P51812 1/20 0.39
DYRK1A Q13627 1/20 0.39
PIM3 Q86V86 1/20 0.39
CSNK1G3 Q9Y6M4 1/20 0.39
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.35
CYP2C19 P33261 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
SCHEMBL9525823 0.94 KDM4E (0.40) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL10566885 0.92 PRKD3 (0.42) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9523618 0.91 KDM4E (0.43) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9523401 0.88 LMNA (0.41) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9522639 0.87 KDM4E (0.44) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9522606 0.87 LMNA (0.51) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9232558 0.84 LMNA (0.43) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9522681 0.84 KDM4E (0.45) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9522727 0.83 KDM4E (0.47) KDM4EHPGDALDH1A1HSD17B10LMNA
SCHEMBL9522092 0.82 PRKD3 (0.42) KDM4EHPGDALDH1A1HSD17B10LMNA

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-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