SCHEMBL4201586

SCHEMBL4201586

CC(CC1CCNCC1)NCc1ccccc1NC(=O)c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RAB9A P51151 1/20 0.41
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
TBK1 Q9UHD2 1/20 0.39
GAA P10253 1/20 0.39
POLB P06746 2/20 0.38
NOX1 Q9Y5S8 1/20 0.38
NAMPT P43490 2/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM1A O60341 1/20 0.37
RCOR1 Q9UKL0 1/20 0.37
HDAC1 Q13547 1/20 0.37
LMNA P02545 1/20 0.37
ROCK2 O75116 1/20 0.37

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
SCHEMBL4192323 0.91 KMT2A (0.44) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4186006 0.91 KMT2A (0.44) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4198225 0.90 CTSL (0.44) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4190624 0.90 CTSL (0.44) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4197332 0.90 CTSL (0.44) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4199680 0.84 CHRM3 (0.41) KMT2AALDH1A1POLBKDM4EL3MBTL1
SCHEMBL4707714 0.83 MAPT (0.54) KMT2AALDH1A1NPSR1HSD17B10POLB
SCHEMBL4190138 0.80 LDLR (0.48) ALDH1A1TP53GAAKDM4EL3MBTL1
SCHEMBL4709435 0.80 KMT2A (0.43) KMT2AALDH1A1TP53NPSR1HSD17B10
SCHEMBL4203591 0.79 LDLR (0.49) ALDH1A1TP53GAAKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP claimed
US-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 US claimed
CN-101203504-A Antimicrobial agents RANBAXY LAB LTD (IN) 2008-06-18 CN claimed
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP claimed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO claimed
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP disclosed
CN-101203504-B Antimicrobial agents RANBAXY LAB LTD 2012-11-14 CN disclosed
US-8076370-B2 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2011-12-13 US disclosed
US-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 US disclosed
CN-101203504-A Antimicrobial agents RANBAXY LAB LTD (IN) 2008-06-18 CN disclosed
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 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 (1 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-20090215764-A1 Antimicrobial agents TUFM, RPS17, HARS1 KMT2A 2047/4885ALDH1A1 2744/4885TP53 2324/4885

“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.