SCHEMBL31089772

SCHEMBL31089772

Cc1cc(F)ccc1-c1cc(=O)oc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ MAOA P21397 1/20 0.49
▸ NQO1 P15559 1/20 0.46
▸ KCNA3 P22001 3/20 0.46
▸ CA12 O43570 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ CA1 P00915 1/20 0.45
▸ ESR1 P03372 1/20 0.43
▸ GABRP O00591 2/20 0.42
▸ GABRD O14764 2/20 0.42
▸ GABRA1 P14867 2/20 0.42
▸ GABRB1 P18505 2/20 0.42
▸ GABRG2 P18507 2/20 0.42
▸ GABRB3 P28472 2/20 0.42
▸ GABRA5 P31644 2/20 0.42
▸ GABRA3 P34903 2/20 0.42
▸ GABRA2 P47869 2/20 0.42
▸ GABRB2 P47870 2/20 0.42

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
SCHEMBL30228412 0.83 KCNA3 (0.62) ALDH1A1LMNASMN1; SMN2MAOANQO1
SCHEMBL5691199 0.83 KCNA3 (0.62) ALDH1A1LMNASMN1; SMN2MAOANQO1
SCHEMBL31089799 0.82 CA12 (0.51) ALDH1A1LMNASMN1; SMN2MAOANQO1
SCHEMBL20848059 0.82 CA12 (0.61) ALDH1A1LMNAMAOACA12CA9
SCHEMBL5396825 0.80 NQO1 (0.67) ALDH1A1LMNASMN1; SMN2MAOANQO1
SCHEMBL14424530 0.80 ALDH1A1 (0.58) ALDH1A1LMNASMN1; SMN2MAOAKCNA3
SCHEMBL9845372 0.78 GABRP (0.58) MAOANQO1CA12CA9CA1
SCHEMBL13769007 0.76 LMNA (0.59) ALDH1A1LMNASMN1; SMN2MAOANQO1
SCHEMBL14424526 0.76 GABRP (0.50) LMNANQO1CA12CA9CA1
SCHEMBL30228452 0.75 ALDH1A1 (0.59) ALDH1A1LMNASMN1; SMN2MAOANQO1

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-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION LEAD DISCOVERY CENTER GMBH (DE) 2024-08-01 — — 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-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION TFAM, POLRMT, TUFM ALDH1A1 3415/4885LMNA 2116/4885SMN1; SMN2 3385/4885

“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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