SCHEMBL5732577

SCHEMBL5732577

Cc1ccc(-c2ccc3c(=O)c(C(=O)O)cn(C4CC4)c3c2C)cn1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 9/20 0.52
▸ TOP2B Q02880 9/20 0.52
▸ KCNH2 Q12809 5/20 0.44
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRD1 P41143 1/20 0.38

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
SCHEMBL5733827 0.91 TOP2A (0.47) TOP2ATOP2BKCNH2KDM4EALDH1A1
SCHEMBL5735858 0.90 TOP2A (0.46) TOP2ATOP2BKCNH2KDM4EMEN1
SCHEMBL5742293 0.88 PIK3CG (0.48) TOP2ATOP2BKCNH2
SCHEMBL5733920 0.88 TOP2A (0.45) TOP2ATOP2BKCNH2KDM4EPOLB
SCHEMBL5732430 0.87 TOP2A (0.44) TOP2ATOP2BKCNH2KDM4EMEN1
SCHEMBL5732650 0.87 ADRB2 (0.43) TOP2ATOP2BKCNH2KDM4EMEN1
SCHEMBL5732959 0.87 TOP2A (0.50) TOP2ATOP2BKCNH2KDM4EALDH1A1
SCHEMBL5732731 0.86 TOP2A (0.62) TOP2ATOP2BKCNH2KDM4ELMNA
SCHEMBL5732781 0.86 TOP2A (0.62) TOP2ATOP2BKCNH2KDM4E
SCHEMBL5735039 0.85 TOP2A (0.51) TOP2ATOP2BKCNH2KDM4EALDH1A1

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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