SCHEMBL27014164

SCHEMBL27014164

OC1CCc2cc(F)ccc2[C@H]1N1C[C@H]2COC[C@H]2C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.38
▸ SRD5A1 P18405 3/20 0.37
▸ HTR1A P08908 5/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ IDO1 P14902 1/20 0.33
▸ TRPV1 Q8NER1 2/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ HTR2A P28223 1/20 0.32

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
SCHEMBL27014168 0.78 SRD5A1 (0.41) NAMPTSRD5A1HTR1AIDO1KDM5A
SCHEMBL27014163 0.78 SRD5A1 (0.41) NAMPTSRD5A1HTR1AIDO1KDM5A
SCHEMBL25079090 0.73 NAMPT (0.38) NAMPTSRD5A1HTR1ACYP2D6DRD2
SCHEMBL16363092 0.68 SRD5A1 (0.45) SRD5A1HTR1AIDO1TRPV1DRD2
SCHEMBL1745527 0.68 SRD5A1 (0.45) SRD5A1HTR1AIDO1TRPV1DRD2
SCHEMBL16363081 0.68 SRD5A1 (0.45) SRD5A1HTR1AIDO1TRPV1DRD2
SCHEMBL8710061 0.66 SRD5A1 (0.45) SRD5A1HTR1ACYP2D6IDO1DRD2
SCHEMBL4119987 0.65 CNR2 (0.43) IDO1
SCHEMBL4119991 0.65 CNR2 (0.43) IDO1
SCHEMBL4119985 0.65 CNR2 (0.43) IDO1

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 NAMPT 129/4885SRD5A1 4075/4885HTR1A 2628/4885

“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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