SCHEMBL3757785

SCHEMBL3757785

C=C(C)n1c(=O)n(CCN2CCC(CN(C(=O)CC)c3ccc(Cl)c(Cl)c3)CC2)c2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 9/20 0.69
TACR1 P25103 4/20 0.69
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 1/20 0.39
CNR2 P34972 2/20 0.39
CCR5 P51681 3/20 0.38
OPRD1 P41143 2/20 0.38

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
SCHEMBL3689703 0.93 TACR1 (0.67) OPRM1TACR1LMNAGAAMAPT
SCHEMBL3650479 0.91 TACR1 (0.66) OPRM1TACR1LMNAGAAMAPT
SCHEMBL3757984 0.91 OPRM1 (0.76) OPRM1TACR1ACHECNR2CCR5
SCHEMBL3764460 0.89 OPRM1 (0.65) OPRM1TACR1ACHEOPRD1
SCHEMBL3647412 0.87 OPRM1 (0.57) OPRM1TACR1OPRD1
SCHEMBL8564833 0.87 OPRM1 (0.83) OPRM1TACR1OPRD1
SCHEMBL3686831 0.86 OPRM1 (0.56) OPRM1TACR1ACHE
SCHEMBL3694300 0.83 OPRM1 (0.52) OPRM1TACR1ACHEOPRD1
SCHEMBL8568874 0.82 OPRM1 (0.81) OPRM1TACR1LMNAGAAMAPT
SCHEMBL3647404 0.82 OPRM1 (0.47) OPRM1TACR1GAAMAPTACHE

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-20100298380-A1 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THIER USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-11-25 US claimed
US-20100298380-A1 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THIER USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-11-25 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-20100298380-A1 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THIER USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC6A4 OPRM1 124/4885TACR1 83/4885LMNA 4411/4885

“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.