SCHEMBL14422387

SCHEMBL14422387

COC(=O)N1CCN(C(=O)c2ccc(C)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.66
▸ PKM P14618 1/20 0.66
▸ GAA P10253 2/20 0.62
▸ NPSR1 Q6W5P4 2/20 0.62
▸ HPGD P15428 2/20 0.60
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ LMNA P02545 3/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ TSHR P16473 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ GPR183 P32249 1/20 0.53

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
SCHEMBL10726712 0.87 ALDH1A1 (0.84) ALDH1A1PKMHPGDKMT2AMEN1
SCHEMBL4557193 0.87 ALDH1A1 (0.84) ALDH1A1PKMHPGDKMT2AMEN1
SCHEMBL17559469 0.86 HPGD (0.61) ALDH1A1GAAHPGDKMT2AMEN1
SCHEMBL17572996 0.86 ALDH1A1 (0.54) ALDH1A1GAANPSR1HPGDKMT2A
SCHEMBL17559397 0.85 ALDH1A1 (0.53) ALDH1A1GAANPSR1HPGDKMT2A
SCHEMBL12302070 0.85 GAA (0.77) ALDH1A1PKMGAANPSR1HPGD
Lithium Ion SCHEMBL17559395 0.83 ALDH1A1 (0.51) ALDH1A1PKMGAANPSR1HPGD
SCHEMBL29188760 0.82 KMT2A (0.70) ALDH1A1PKMGAANPSR1HPGD
SCHEMBL10194850 0.80 PKM (0.72) ALDH1A1PKMHPGDKMT2AMEN1
SCHEMBL82433 0.80 ALDH1A1 (0.72) ALDH1A1PKMHPGDKMT2AMEN1

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-20070225296-A1 Arylalkylamine Compound and Process for Preparing the Same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-09-27 — — US disclosed
US-20070225296-A1 Arylalkylamine Compound and Process for Preparing the Same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-09-27 — — 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-20070225296-A1 Arylalkylamine Compound and Process for Preparing the Same CASR, CNR1, CNR2 ALDH1A1 3487/4885PKM 2601/4885GAA 3620/4885

“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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