SCHEMBL3266159

SCHEMBL3266159

NC(=O)COC(=O)NCCC1CCN(c2ccc(N)nn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.41
TPSD1 Q9BZJ3 1/20 0.41
TPSG1 Q9NRR2 1/20 0.41
SCD O00767 8/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
SIRT3 Q9NTG7 1/20 0.38
CHRM4 P08173 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL3270022 0.89 SCD (0.43) TPSAB1TPSD1TPSG1SCDMEN1
SCHEMBL3268959 0.85 SCD (0.42) SCDMEN1KMT2ACHRM4
SCHEMBL1728747 0.83 SCD (0.45) SCDCHRM4
SCHEMBL3268956 0.83 TPSAB1 (0.41) TPSAB1TPSD1TPSG1SIRT2SIRT1
SCHEMBL3269077 0.81 CHRM4 (0.49) TPSAB1TPSD1TPSG1KMT2ASIRT2
SCHEMBL3266256 0.81 DEGS1 (0.48) CHRM4KDM4E
SCHEMBL3266210 0.81 CHRM4 (0.45) TPSAB1TPSD1TPSG1SIRT2SIRT1
SCHEMBL240267 0.81 PDE10A (0.44) KDM4E
SCHEMBL3269081 0.80 CHRM4 (0.57) KMT2ASMN1; SMN2CHRM4KDM4E
SCHEMBL3265639 0.80 HRH3 (0.44) KMT2ASMN1; SMN2SIRT2SIRT1SIRT3

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-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES SANOFI-AVENTIS (FR) 2012-01-05 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-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES CLCN2, CLIC1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 TPSAB1 3455/4885TPSD1 3757/4885TPSG1 3860/4885

“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.