SCHEMBL7862768

SCHEMBL7862768

CCOC(=O)c1cn(C2CC2)c2cc(-c3cc(C)nc(C)c3)c(F)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 9/20 0.52
TOP2B Q02880 9/20 0.52
ADRB2 P07550 1/20 0.49
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL9720466 0.93 TOP2A (0.45) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL9720459 0.92 TOP2A (0.45) TOP2ATOP2BADRB2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL9720598 0.92 TOP2A (0.45) TOP2ATOP2BADRB2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL9720534 0.91 TOP2A (0.44) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL9720497 0.91 TOP2A (0.43) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL9720525 0.89 ADRB2 (0.46) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL7866482 0.87 TOP2A (0.67) TOP2ATOP2BKDM4EALDH1A1HPGD
SCHEMBL4306583 0.86 KMT2A (0.60) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL29576844 0.86 KMT2A (0.60) TOP2ATOP2BADRB2KDM4EALDH1A1
SCHEMBL10727441 0.84 ALDH1A1 (0.58) KDM4EALDH1A1HPGDHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700399-B1 36-DERIVATIVES OF RIFAMYCINS AND THEIR USE AS ANTIMICROBIAL AGENTS LEPETIT SPA (IT) 2001-10-04 EP disclosed
US-5786350-A CONDENSATION; HYDROLYSIS; DEPROTECTING GRUPPO LEPETIT S.P.A. (IT) 1998-07-28 US disclosed
EP-0700399-A1 36-DERIVATIVES OF RIFAMYCINS AND THEIR USE AS ANTIMICROBIAL AGENTS GRUPPO LEPETIT S.P.A. (IT) 1996-03-13 EP disclosed
WO-1994028002-A1 36-DERIVATIVES OF RIFAMYCINS AND THEIR USE AS ANTIMICROBIAL AGENTS GRUPPO LEPETIT S.P.A. (IT) 1994-12-08 WO disclosed
US-5169853-A Antibacterial agents; administering to mammals for infection STERLING DRUG INC. (US) 1992-12-08 US disclosed
US-5075319-A Bactericides STERLING DRUG INC. (US) 1991-12-24 US disclosed
EP-0417669-A2 Pyridinyl-quinolone compounds, their preparation and use STERLING WINTHROP INC. (US) 1991-03-20 EP disclosed
EP-0309789-A1 4-Oxo-3-quinolinecarboxylic acids useful as antibacterial agents and preparation thereof STERLING WINTHROP INC. (US) 1989-04-05 EP disclosed