SCHEMBL4649542

SCHEMBL4649542

CCCN1Cc2ccccc2CC1C(=O)NC1C2CCC1CN(Cc1ccccc1)C2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.41
MMP9 P14780 2/20 0.39
MMP3 P08254 2/20 0.39
MMP1 P03956 1/20 0.39
ADAM17 P78536 1/20 0.39
ADAM9 Q13443 1/20 0.39
GLA P06280 1/20 0.39
HDAC8 Q9BY41 2/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
POLB P06746 2/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
MMP8 P22894 2/20 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
SCHEMBL4649247 0.86 SIGMAR1 (0.44) NAMPTTSHR
SCHEMBL4649758 0.83 POLB (0.46) NAMPTMMP3POLBMMP8
SCHEMBL4622160 0.81 MMP9 (0.39) NAMPTMMP9MMP3MMP1ADAM17
SCHEMBL4649730 0.80 NAMPT (0.42) NAMPTMMP1POLBTSHRMMP8
SCHEMBL4925914 0.80 HDAC8 (0.48) NAMPTHDAC8POLB
SCHEMBL4622472 0.78 CHRM1 (0.39) MMP3GLAHDAC8TSHRMMP8
SCHEMBL4925547 0.75 NR1D1 (0.40) NAMPTMMP9MMP3MMP1ADAM17
SCHEMBL4650499 0.75 KMT2A (0.51) POLB
SCHEMBL21737968 0.74 GRIN2B (0.48)
SCHEMBL2849565 0.74 GRIN2B (0.50) POLB

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 2092/4885MMP9 3432/4885MMP3 3787/4885

“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.