SCHEMBL19473333

SCHEMBL19473333

COC(=O)N1CCC(N(C)C(=O)C(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2D6 P10635 1/20 0.38
NPY5R Q15761 1/20 0.37
EPHX1 P07099 1/20 0.37
PER2 O15055 1/20 0.37
CRY1 Q16526 1/20 0.37
CRY2 Q49AN0 1/20 0.37
CCR5 P51681 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
ADAM10 O14672 1/20 0.35
ERBB2 P04626 1/20 0.35
MMP2 P08253 1/20 0.35
BRD4 O60885 2/20 0.35
BRDT Q58F21 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
AAK1 Q2M2I8 1/20 0.35

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
SCHEMBL19419455 0.81 NPY5R (0.43) NPY5REPHX1CCR5L3MBTL3DPP4
SCHEMBL17572098 0.81 DPP4 (0.41) NPY5REPHX1PER2CRY1CRY2
SCHEMBL26860565 0.80 ALDH1A1 (0.42) CYP2C9CYP2D6CCR5KMT2ADPP4
SCHEMBL14388985 0.79 L3MBTL3 (0.53) CYP1A2CYP2C9EPHX1PER2CRY1
SCHEMBL8296781 0.78 DPP4 (0.37) CYP1A2CYP2C9EPHX1MEN1KMT2A
SCHEMBL800697 0.78 HTT (0.45) CCR5KMT2ABRD4DPP4DPP9
SCHEMBL19419451 0.77 NPY5R (0.44) NPY5REPHX1CCR5DPP4DPP9
SCHEMBL771728 0.77 ADH1C (0.46) CYP1A2CYP2C9EPHX1PER2CRY1
SCHEMBL16219008 0.76 DPP4 (0.47) CCR5DPP4DPP9
SCHEMBL23798138 0.76 BRD4 (0.41) CYP2D6CCR5MEN1KMT2ABRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3426648-B1 TETRAHYDROISOQUINOLINES AS PRMT5 INHIBITORS CTXT PTY LTD (AU) 2021-05-12 EP disclosed
EP-3189042-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-03-17 EP disclosed
EP-3426640-B1 PRMT5 INHIBITORS CTXT PTY LTD (AU) 2020-11-18 EP disclosed
EP-3426647-B1 TETRAHYDROISOQUINOLINES AS PRMT5-INHIBITORS CTXT PTY LTD (AU) 2020-11-18 EP disclosed
US-10005792-B2 Aminoindane-, aminotetrahydronaphthalene- and aminobenzocyclobutane-derived PRMT5-inhibitors CTXT PTY. LTD. (AU) 2018-06-26 US disclosed
US-20170313713-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-11-02 US disclosed
US-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-10-19 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 (3 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-10005792-B2 Aminoindane-, aminotetrahydronaphthalene- and aminobenzocyclobutane-derived PRMT5-inhibitors PRMT5, PRMT1, PRMT3 CYP1A2 767/4885CYP2C9 1730/4885CYP2D6 1025/4885
US-20170313713-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS PRMT5, PRMT1, PRMT3 CYP1A2 820/4885CYP2C9 1866/4885CYP2D6 1110/4885
US-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS PRMT5, PRMT1, PRMT3 CYP1A2 1959/4885CYP2C9 2587/4885CYP2D6 1643/4885

“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.