SCHEMBL4899599

SCHEMBL4899599

CCCC(C(N)=O)(c1ccccc1)N1CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 9/20 0.40
CHRM2 P08172 5/20 0.40
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
OPRD1 P41143 2/20 0.37
HTT P42858 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
SCHEMBL4558669 0.90 CHRM3 (0.41) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL4901870 0.87 CYP2B6 (0.45) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL18765527 0.85 OPRM1 (0.49) CHRM3CHRM2KMT2AMEN1SMN1; SMN2
SCHEMBL5816021 0.80 CYP2B6 (0.43) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL18112743 0.77 CYP2B6 (0.41) CHRM3CHRM2CHRM1SIGMAR1OPRD1
SCHEMBL4558785 0.76 KMT2A (0.40) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL10760122 0.76 CYP2B6 (0.39) CHRM3CHRM2KMT2ACHRM4CHRM5
SCHEMBL12806774 0.75 CHRM2 (0.47) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL4559545 0.75 SIGMAR1 (0.44) CHRM3CHRM2KMT2AMAPTCHRM4
SCHEMBL4559549 0.74 KMT2A (0.41) CHRM3CHRM2KMT2AMAPTCHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153917-A1 Sigma Receptor Ligands UCB PHARMA, S.A. (BE) 2008-06-26 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-20080153917-A1 Sigma Receptor Ligands SIGMAR1, TMEM97, OPRL1 CHRM3 127/4885CHRM2 283/4885KMT2A 2464/4885

“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.