SCHEMBL27014161

SCHEMBL27014161

N[C@H]1c2ccccc2CC[C@@H]1C1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 5/20 0.42
▸ IDO1 P14902 3/20 0.41
▸ CYP19A1 P11511 4/20 0.39
▸ CYP17A1 P05093 1/20 0.39
▸ PDPK1 O15530 1/20 0.38
▸ PLAU P00749 1/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ RET P07949 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR6 P50406 1/20 0.36

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
SCHEMBL21400182 0.80 PRCP (0.45) CYP11B2IDO1PDPK1PLAU
SCHEMBL27014167 0.72 ACHE (0.41) IDO1
SCHEMBL11235903 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL9776879 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL11450268 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL11450267 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL4023125 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL11235907 0.71 IDO1 (0.52) CYP11B2IDO1PDPK1PLAUCA1
SCHEMBL25079056 0.70 IDO1 (0.37) IDO1PDPK1PLAUCA1CA2
Hydrochloric Acid SCHEMBL7334124 0.70 IDO1 (0.53) CYP11B2IDO1PDPK1PLAUCA1

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-20240018146-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ, INC. (US) 2024-01-18 — — US disclosed
US-20240018146-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ, INC. (US) 2024-01-18 — — 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-20240018146-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE PINK1, NME4, AK2 CYP11B2 842/4885IDO1 2783/4885CYP19A1 4264/4885

“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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