SCHEMBL1366635

SCHEMBL1366635

CCn1cc(C(=O)O)c(=O)c2cc(Cl)ccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.68
HPGD P15428 4/20 0.68
HSD17B10 Q99714 4/20 0.68
ALDH1A1 P00352 3/20 0.68
TSHR P16473 2/20 0.68
RAB9A P51151 1/20 0.68
LMNA P02545 6/20 0.62
HTT P42858 2/20 0.62
CYP1A2 P05177 1/20 0.61
CYP2D6 P10635 1/20 0.61
APEX1 P27695 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
PIK3CD O00329 1/20 0.54
PIK3R1 P27986 1/20 0.54
PIK3CA P42336 1/20 0.54
PIK3CG P48736 1/20 0.54
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.50
DRD3 P35462 1/20 0.50
ABCC4 O15439 1/20 0.50

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
SCHEMBL28117698 0.99 KDM4E (0.67) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL12485507 0.90 KDM4E (0.54) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL30906937 0.89 KDM4E (0.57) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL5544803 0.89 KDM4E (0.57) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL3979676 0.84 KDM4E (0.70) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL7057692 0.84 KDM4E (0.70) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL5544822 0.84 LMNA (0.73) ALDH1A1LMNA
SCHEMBL9027382 0.83 KDM4E (0.68) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL30390219 0.83 KDM4E (0.68) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL11948562 0.83 KDM4E (0.68) KDM4EHPGDHSD17B10ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104292159-B A kind of preparation method of norfloxacin, ciprofloxacin and enrofloxacin 浙江同丰医药化工有限公司 2016-12-07 CN disclosed
US-8889706-B2 Soluble mTOR complexes and modulators thereof WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-11-18 US disclosed
EP-2350053-B1 Modulators of MTOR Complexes WHITEHEAD BIOMEDICAL INST (US) 2013-12-11 EP disclosed
CN-103420938-A Method for recovering piperazine after piperazine condensation reaction in quinolone medicine preparation ZHEJIANG JINGXIN PHARMACEUTICAL CO LTD 2013-12-04 CN disclosed
US-20130072485-A1 SOLUBLE MTOR COMPLEXES AND MODULATORS THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2013-03-21 US disclosed
US-8394818-B2 Soluble mTOR complexes and modulators thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2013-03-12 US disclosed
US-20110288091-A1 SOLUBLE MTOR COMPLEXES AND MODULATORS THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2011-11-24 US disclosed
US-7323596-B2 Antibacterial or antiprotozoal activity: formula (1) formula (2) wherein: Z represents a radical of formula N(OH)CH( .dbd. O) or of formula C( .dbd. O)NH(OH); R1 represents hydrogen, methyl or trifluoromethyl, or, except when Z is a radical of DE NOVO PHARMACEUTICALS LTD. (GB) 2008-01-29 US disclosed
US-20040102491-A1 Antimicrobial agents DE NOVO PHARMACEUTICALS LTD. (GB) 2004-05-27 US disclosed
EP-1343753-A2 ANTIMICROBIAL AGENTS De Novo Pharmaceuticals Ltd. (GB) 2003-09-17 EP disclosed
WO-2002050081-A2 ANTIMICROBIAL AGENTS DE NOVO PHARMACEUTICALS LTD (GB) 2002-06-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130072485-A1 SOLUBLE MTOR COMPLEXES AND MODULATORS THEREOF MTOR, RICTOR, RPTOR KDM4E 2853/4885HPGD 3777/4885HSD17B10 3334/4885
US-20110288091-A1 SOLUBLE MTOR COMPLEXES AND MODULATORS THEREOF MTOR, RICTOR, RPTOR KDM4E 2853/4885HPGD 3777/4885HSD17B10 3334/4885
US-20040102491-A1 Antimicrobial agents CBR1, CYC1, MRM1 KDM4E 2673/4885HPGD 2093/4885HSD17B10 431/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.