SCHEMBL20848106

SCHEMBL20848106

Cc1cscc1-c1cc(=O)oc2cc(OC(C)C(=O)OC(C)(C)C)ccc12

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH2 P05091 1/20 0.55
▸ ALDH1A1 P00352 11/20 0.51
▸ HPGD P15428 10/20 0.51
▸ KDM4E B2RXH2 8/20 0.49
▸ RECQL P46063 2/20 0.49
▸ AR P10275 2/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ IGLV6-57 P01721 1/20 0.43
▸ KMT2A Q03164 1/20 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
SCHEMBL20839153 1.00 ALDH2 (0.55) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL22431698 0.86 ALDH1A1 (0.68) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL21629629 0.82 ALDH1A1 (0.76) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL30056522 0.82 ALDH1A1 (0.76) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839592 0.79 ALDH2 (0.57) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839593 0.79 ALDH2 (0.57) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839136 0.79 ALDH1A1 (0.62) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839135 0.79 ALDH1A1 (0.62) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839174 0.76 ALDH1A1 (0.59) ALDH2ALDH1A1HPGDKDM4ERECQL
SCHEMBL20839176 0.76 ALDH1A1 (0.59) ALDH2ALDH1A1HPGDKDM4ERECQL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111386261-B Coumarin derivatives, process for their preparation and their use in the treatment of cancer 利德发现中心有限责任公司 2024-03-22 — — CN disclosed
EP-3684762-B1 COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2023-05-03 — — EP disclosed
US-11111238-B2 Coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer LEAD DISCOVERY CENTER GMBH (DE) 2021-09-07 — — US disclosed
US-20200291011-A1 COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2020-09-17 — — US disclosed
CN-111386261-A Coumarin derivatives, preparation method thereof and application thereof in cancer treatment 利德发现中心有限责任公司 2020-07-07 — — CN disclosed
WO-2019057821-A1 COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER LEAD DISCOVERY CENTER GMBH (DE) 2019-03-28 — — WO 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 (2 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-11111238-B2 Coumarin derivatives, processes for their preparation and uses thereof for the treatment of cancer POLRMT, UQCRC2, UQCRC1 ALDH2 147/4885ALDH1A1 1261/4885HPGD 947/4885
US-20200291011-A1 COUMARIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF FOR THE TREATMENT OF CANCER POLRMT, UQCRC2, UQCRC1 ALDH2 147/4885ALDH1A1 1261/4885HPGD 947/4885

“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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