SCHEMBL3687401

SCHEMBL3687401

CCCCCNCC1CCNCC1

nearest known ligand 0.93

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 10/20 0.93
GNAI3 P08754 9/20 0.93
GNAI1 P63096 9/20 0.93
SAT1 P21673 1/20 0.50
EPHX1 P07099 1/20 0.49
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
PRCP P42785 1/20 0.41
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
ANPEP P15144 1/20 0.40
ERAP2 Q6P179 1/20 0.40
ALOX15 P16050 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 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
SCHEMBL2839904 0.98 GNAO1 (0.96) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL3652066 0.98 GNAO1 (0.96) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL7328368 0.94 GNAO1 (0.83) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL5963013 0.90 GNAI3 (0.75) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL8135765 0.89 GNAO1 (0.75) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL13772115 0.86 GNAO1 (0.70) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL7766302 0.86 GNAI3 (0.69) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL1678880 0.86 GNAI3 (0.69) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL19414059 0.84 GNAI3 (0.72) GNAO1GNAI3GNAI1SAT1EPHX1
SCHEMBL1933069 0.84 GNAI3 (0.72) GNAO1GNAI3GNAI1SAT1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4194457-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Leadingtac Pharmaceutical Co., Ltd. (CN) 2023-06-14 EP disclosed
CN-105646331-B Piperidine compounds, the medical composition and its use containing the compound 爱思开生物制药株式会社 2018-07-03 CN disclosed
CN-103980184-B Piperidine compounds, medical composition and its use containing this compound 爱思开生物制药株式会社 2016-08-24 CN disclosed
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
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
EP-2183240-A2 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NeuroSearch AS (DK) 2010-05-12 EP disclosed
WO-2009016215-A3 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH AS (DK) 2009-06-18 WO disclosed
WO-2009016215-A2 N-ARYL-N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2009-02-05 WO 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 GNAO1 1099/4885GNAI3 885/4885GNAI1 1025/4885

“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.