SCHEMBL4649730

SCHEMBL4649730

CCCN1Cc2ccccc2CC1C(=O)NC1C2CCC1CN(CCc1ccc3c(c1)OCO3)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.42
KMT2A Q03164 4/20 0.40
POLB P06746 3/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 5/20 0.40
TSHR P16473 2/20 0.40
ADRA1D P25100 2/20 0.40
ADRA1A P35348 2/20 0.40
ADRA1B P35368 2/20 0.40
MAPK1 P28482 2/20 0.39
GAA P10253 1/20 0.39
MAPK10 P53779 1/20 0.39
MMP1 P03956 1/20 0.39
MMP7 P09237 1/20 0.39
MMP8 P22894 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
ALOX15 P16050 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
SCHEMBL4649247 0.93 SIGMAR1 (0.44) NAMPTKMT2AALDH1A1TSHRMAPK1
SCHEMBL4622472 0.89 CHRM1 (0.39) TSHRADRA1AMMP8
SCHEMBL4649174 0.81 TSHR (0.42) NAMPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL4649542 0.80 NAMPT (0.41) NAMPTPOLBTSHRMMP1MMP8
SCHEMBL4649360 0.78 SIGMAR1 (0.48) ALDH1A1TSHRSIGMAR1
SCHEMBL4648949 0.76 PTPN1 (0.45) NAMPTKMT2APOLBMEN1MAPT
SCHEMBL4803652 0.76 PTPN1 (0.42) ALDH1A1TSHRSIGMAR1
SCHEMBL4650554 0.75 CHRM1 (0.41) POLBADRA1AMMP8
SCHEMBL4925770 0.73 PTPN1 (0.44) ADRA1A
SCHEMBL2601969 0.72 NAMPT (0.53) NAMPTTDP1ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255188-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-16 US claimed
EP-1904495-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-04-02 EP claimed
WO-2007007281-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-18 WO claimed
US-20080255188-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-16 US disclosed
EP-1904495-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-04-02 EP disclosed
WO-2007007281-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-18 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-20080255188-A1 Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 NAMPT 2092/4885KMT2A 3036/4885POLB 3669/4885

“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.