SCHEMBL9805938

SCHEMBL9805938

O=C(O)c1cn(C2CC2)c2cc(N3CCC(O)CC3)ncc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ TOP2A P11388 3/20 0.50
▸ TOP2B Q02880 3/20 0.50
▸ HPGD P15428 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ MAPT P10636 1/20 0.48
▸ PIK3CG P48736 4/20 0.47
▸ POLB P06746 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ PIK3CD O00329 2/20 0.42
▸ PIK3R1 P27986 2/20 0.42
▸ PIK3CA P42336 2/20 0.42
▸ KCNH2 Q12809 1/20 0.40

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
SCHEMBL5680002 0.88 KDM4E (0.53) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL11118048 0.86 PIK3CG (0.38) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL5683277 0.79 KDM4E (0.48) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL5681662 0.78 KDM4E (0.51) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL6665312 0.78 KDM4E (0.47) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL9066138 0.77 KDM4E (0.48) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL8692421 0.76 KDM4E (0.42) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL7851044 0.76 KDM4E (0.42) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL9735289 0.75 KDM4E (0.72) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL9734255 0.75 KDM4E (0.72) KDM4EALDH1A1LMNATOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5077429-A 7-AMINO-1-CYCLOPROPYL-4-OXO-1,4-DIHYDRO-QUINOLINE- AND NAPHTHYRIDINE-3-CARBOXYLIC ACIDS, PROCESSES FOR THEIR PREPARATION AND ANTIBACTERIAL AGENTS CONTAINING THESE COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1991-12-31 — — US disclosed
US-4670444-A 7-amino-1-cyclopropyl-4-oxo-1, 4-dihydro-quinoline-and naphthyridine-3-carboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1987-06-02 — — US disclosed
US-4620007-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1986-10-28 — — US disclosed
EP-0049355-B1 7-Amino-1-cyclopropyl-4-oxo-1,4-dihydro-(naphthyridine or quinoline)-3-carboxylic acids, process for their preparation and pharmaceutical compositions containing them BAYER AG (DE) 1984-10-10 — — EP disclosed
EP-0049355-A1 7-Amino-1-cyclopropyl-4-oxo-1,4-dihydro-(naphthyridine or quinoline)-3-carboxylic acids, process for their preparation and pharmaceutical compositions containing them BAYER AG (DE) 1982-04-14 — — EP disclosed
Send feedback