SCHEMBL3268959

SCHEMBL3268959

NC(=O)COC(=O)NCCC1CCN(c2ccc(-c3ccccc3)nn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCD O00767 3/20 0.42
CHRNA7 P36544 1/20 0.42
ACHE P22303 2/20 0.42
NPC1 O15118 7/20 0.42
RAB9A P51151 7/20 0.42
BCHE P06276 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CHRM4 P08173 2/20 0.41
HSP90AA1 P07900 1/20 0.40
PAX8 Q06710 1/20 0.40

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
SCHEMBL3265598 0.90 CKS1B (0.46) SCDCHRNA7NPC1RAB9A
SCHEMBL3265609 0.86 CKS1B (0.41) CHRM4
SCHEMBL3270022 0.85 SCD (0.43) SCDMEN1KMT2ACHRM4
SCHEMBL3266159 0.85 TPSAB1 (0.41) SCDMEN1KMT2ACHRM4
SCHEMBL1729322 0.85 CHRNA7 (0.49) SCDCHRNA7ACHENPC1RAB9A
SCHEMBL3265698 0.82 CHRM4 (0.48) CHRM4
SCHEMBL240267 0.80 PDE10A (0.44)
SCHEMBL3265618 0.79 CNR1 (0.41) NPC1RAB9ACHRM4
SCHEMBL3265672 0.78 CHRM4 (0.45) CHRM4
SCHEMBL3265727 0.78 HCAR2 (0.45) NPC1RAB9ACHRM4

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 SCD 4356/4885CHRNA7 169/4885ACHE 401/4885

“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.