SCHEMBL21629532

SCHEMBL21629532

C[C@@H](Oc1ccc2c(-c3ccccc3)cc(=O)oc2c1)C(=O)N(C)C

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.79
▸ HPGD P15428 7/20 0.79
▸ KDM4E B2RXH2 3/20 0.65
▸ RECQL P46063 2/20 0.65
▸ USP2 O75604 1/20 0.60
▸ LMNA P02545 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ CA9 Q16790 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ RAB9A P51151 1/20 0.58
▸ ESR1 P03372 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ MAOB P27338 1/20 0.55
▸ AR P10275 1/20 0.55

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
SCHEMBL21629535 1.00 ALDH1A1 (0.79) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL21629540 0.88 ALDH1A1 (1.00) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL21629541 0.88 ALDH1A1 (1.00) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL30426019 0.87 ALDH1A1 (0.84) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL2418578 0.87 ALDH1A1 (0.84) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL31622307 0.87 ALDH1A1 (0.59) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL30360855 0.87 ALDH1A1 (0.59) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL20839406 0.87 ALDH1A1 (0.59) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL20839115 0.87 ALDH1A1 (0.59) ALDH1A1HPGDKDM4ERECQLUSP2
SCHEMBL30055780 0.87 ALDH1A1 (0.59) ALDH1A1HPGDKDM4ERECQLUSP2

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 9 patents. 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 claimed
US-10703735-B2 4-phenyl-coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer LEAD DISCOVERY CENTER GMBH (DE) 2020-07-07 — — US claimed
US-20200031794-A1 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2020-01-30 — — US claimed
US-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION LEAD DISCOVERY CENTER GMBH (DE) 2024-08-01 — — US disclosed
US-10703735-B2 4-phenyl-coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer LEAD DISCOVERY CENTER GMBH (DE) 2020-07-07 — — US disclosed
US-10703735-B2 4-phenyl-coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer LEAD DISCOVERY CENTER GMBH (DE) 2020-07-07 — — US disclosed
US-20200031794-A1 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2020-01-30 — — US disclosed
US-20200031794-A1 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2020-01-30 — — US disclosed
EP-3598972-A1 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER Lead Discovery Center GmbH (DE) 2020-01-29 — — EP 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-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION TFAM, POLRMT, TUFM ALDH1A1 3415/4885HPGD 1853/4885KDM4E 1030/4885
US-20200031794-A1 4-PHENYL-COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER POLRMT, COX4I1, UQCRC2 ALDH1A1 1344/4885HPGD 1377/4885KDM4E 1057/4885
US-10703735-B2 4-phenyl-coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer POLRMT, COX4I1, UQCRC2 ALDH1A1 1344/4885HPGD 1377/4885KDM4E 1057/4885

“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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