SCHEMBL5735964

SCHEMBL5735964

CC(=O)N(C)c1ncc(-c2ccc3c(=O)c(C(=O)O)cn(C4CC4)c3c2C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 8/20 0.43
▸ TOP2B Q02880 8/20 0.43
▸ KCNH2 Q12809 5/20 0.39
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GSK3B P49841 1/20 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
SCHEMBL5733481 0.92 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EALDH1A1
SCHEMBL5733125 0.91 TOP2A (0.42) TOP2ATOP2BKCNH2KDM4EPIK3CA
SCHEMBL5732598 0.89 ADRB2 (0.43) TOP2ATOP2BKCNH2ALDH1A1PIK3CA
SCHEMBL5733359 0.86 TOP2A (0.43) TOP2ATOP2BKCNH2KDM4EALDH1A1
SCHEMBL5732959 0.86 TOP2A (0.50) TOP2ATOP2BKCNH2KDM4EALDH1A1
SCHEMBL5733083 0.84 TOP2A (0.47) TOP2ATOP2BKCNH2KDM4EALDH1A1
Ozenoxacin SCHEMBL1711829 0.83 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EGSK3B
SCHEMBL5742552 0.83 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EGSK3B
Ozenoxacin SCHEMBL29379004 0.83 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EGSK3B
Ozenoxacin SCHEMBL2553345 0.82 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EGSK3B

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-1070713-B1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2006-10-18 — — EP disclosed
US-6335447-B1 BACTERICIDES TOYAMA CHEMICAL CO., LTD. (JP) 2002-01-01 — — US disclosed
EP-1070713-A1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2001-01-24 — — EP disclosed
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