SCHEMBL4243239

SCHEMBL4243239

CN(CC1C2CCC1CNC2)C(=O)c1cccc(Cc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
PARP1 P09874 5/20 0.41
ATM Q13315 1/20 0.39
ACHE P22303 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
KDM1A O60341 1/20 0.37
HRH1 P35367 1/20 0.37
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36

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
SCHEMBL4245847 0.71 USP30 (0.67) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL18780834 0.69 L3MBTL1 (0.57) KMT2AMEN1ATML3MBTL1HPGD
SCHEMBL4783285 0.68 PTPN1 (0.41) HRH1
SCHEMBL6489036 0.68 KMT2A (0.53) KMT2AMEN1L3MBTL1HPGDALDH1A1
SCHEMBL15676805 0.66 KMT2A (0.47) KMT2AMEN1PARP1HSD17B1HSD17B2
SCHEMBL4248966 0.66 CHRNB2 (0.38) ALDH1A1GAATSHR
SCHEMBL4241259 0.66 CHRM4 (0.54) ACHE
SCHEMBL30731030 0.66 USP30 (0.51) ACHE
SCHEMBL12751157 0.66 ACHE (0.51) KMT2AMEN1ACHE
SCHEMBL4400803 0.65 ALDH1A1 (0.51) KMT2AMEN1HPGDALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US claimed
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 KMT2A 2913/4885MEN1 1950/4885PARP1 4429/4885

“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.