SCHEMBL22957807

SCHEMBL22957807

CC(C)(C)NCc1ccccc1OC1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 1/20 0.65
▸ NPY2R P49146 1/20 0.65
▸ CARM1 Q86X55 4/20 0.49
▸ PRMT1 Q99873 4/20 0.49
▸ HTT P42858 1/20 0.47
▸ USP2 O75604 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ SLC6A2 P23975 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ DRD3 P35462 1/20 0.43

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
SCHEMBL22957846 0.83 NPY1R (0.70) NPY1RNPY2RKCNH2EPHX2MEN1
SCHEMBL22957841 0.83 NPY1R (0.47) NPY1RNPY2RCARM1PRMT1HTT
SCHEMBL22957689 0.83 CARM1 (0.59) NPY1RNPY2RCARM1PRMT1SLC6A2
SCHEMBL22957770 0.82 NPY1R (0.46) NPY1RNPY2RHTTRIPK1
SCHEMBL22957842 0.81 CARM1 (0.61) NPY1RNPY2RCARM1PRMT1SLC6A4
SCHEMBL22957672 0.81 RIPK1 (0.60) NPY1RNPY2RHTTUSP2CYP1A2
SCHEMBL22957686 0.80 NPY1R (0.53) NPY1RNPY2RCARM1PRMT1USP2
SCHEMBL22957692 0.80 LMNA (0.54) NPY1RNPY2RCARM1PRMT1HRH1
SCHEMBL22390612 0.80 RIPK1 (0.58) NPY1RNPY2RCARM1PRMT1SLC6A2
SCHEMBL15073171 0.77 CARM1 (0.55) NPY1RNPY2RCARM1PRMT1CYP2D6

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-10913738-B2 Aminotriazolopyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 — — 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-10913738-B2 Aminotriazolopyridines as kinase inhibitors RIPK1, RIPK3, RIPK4 NPY1R 2919/4885NPY2R 3582/4885CARM1 960/4885

“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.

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