SCHEMBL5723890

SCHEMBL5723890

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(CO)ccc3nc2-1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 18/20 0.81
▸ MEN1 O00255 3/20 0.81
▸ KMT2A Q03164 3/20 0.81
▸ SMN1; SMN2 Q16637 3/20 0.81
▸ KDM4E B2RXH2 3/20 0.81
▸ ALDH1A1 P00352 3/20 0.81
▸ CYP3A4 P08684 2/20 0.81
▸ HBB P68871 2/20 0.81
▸ CASP1 P29466 1/20 0.81
▸ CASP7 P55210 1/20 0.81
▸ TP53 P04637 2/20 0.77
▸ GLA P06280 2/20 0.77
▸ HPGD P15428 2/20 0.77
▸ STAT6 P42226 1/20 0.77
▸ CHEK1 O14757 1/20 0.77
▸ HDAC3 O15379 1/20 0.77
▸ ABCC4 O15439 1/20 0.77
▸ GMNN O75496 1/20 0.77
▸ LMNA P02545 1/20 0.77
▸ CYP1A2 P05177 1/20 0.77

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
SCHEMBL23358409 0.94 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2986960 0.94 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL28123033 0.93 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL18296582 0.92 TOP1 (0.79) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL9749459 0.92 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL18296774 0.91 TOP1 (0.77) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7055883 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7262395 0.91 TOP1 (0.80) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL29225713 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7764273 0.91 TOP1 (0.77) TOP1MEN1KMT2ASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0056692-A1 7-Substituted camptothecin derivatives and process for their preparation KABUSHIKI KAISHA YAKULT HONSHA (JP) 1982-07-28 — — EP claimed
US-20240156808-A1 Compositions and methods to improve the therapeutic benefit of suboptimally chemical compounds and biological therapies including substituted camptothecins such as irinotecan and topotecan for the treatment of benign and neoplastic hyperproliferative disease conditions, infections, inflammatory and immunological diseases EDISON ONCOLOGY (US) 2024-05-16 — — US disclosed
EP-4297746-A2 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED COMPOUNDS AND THERAPIES FOR THE TREATMENT OF DISEASES Edison Oncology (US) 2024-01-03 — — EP disclosed
US-9034894-B2 Derivate, preparation method and use of 10-methoxycamptothecin NORTHEAST FORESTRY UNIVERSITY (CN) 2015-05-19 — — US disclosed
US-20140194458-A1 DERIVATE, PREPARATION METHOD AND USE OF 10-METHOXYCAMPTOTHECINE NORTHEAST FORESTRY UNIVERSITY (CN) 2014-07-10 — — US disclosed
US-20080051580-A1 Process to Prepare Camptothecin Derivatives and Novel Intermediate and Compounds Thereof CHATHAM BIOTEC, LIMITED (CA) 2008-02-28 — — US disclosed
EP-1003516-A4 METHODS OF ADMINISTERING CAMPTOTHECIN COMPOUNDS FOR THE TREATMENT OF CANCER WITH REDUCED SIDE EFFECTS UNIV GEORGE WASHINGTON (US) 2006-07-12 — — EP disclosed
EP-1003516-A1 METHODS OF ADMINISTERING CAMPTOTHECIN COMPOUNDS FOR THE TREATMENT OF CANCER WITH REDUCED SIDE EFFECTS The George Washington University (US) 2000-05-31 — — EP disclosed
WO-1999065493-A9 METHODS OF ADMINISTERING CAMPTOTHECIN COMPOUNDS FOR THE TREATMENT OF CANCER WITH REDUCED SIDE EFFECTS UNIV GEORGE WASHINGTON (US) 2000-03-23 — — WO disclosed
WO-1999065493-A1 METHODS OF ADMINISTERING CAMPTOTHECIN COMPOUNDS FOR THE TREATMENT OF CANCER WITH REDUCED SIDE EFFECTS THE GEORGE WASHINGTON UNIVERSITY (US) 1999-12-23 — — WO disclosed
WO-1996034003-A1 GLYCOSYLATED ANALOGS OF CAMPTOTHECIN UNIVERSITY OF MICHIGAN (US) 1996-10-31 — — 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 (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-20080051580-A1 Process to Prepare Camptothecin Derivatives and Novel Intermediate and Compounds Thereof TOP2A, TOP1, TOP2B TOP1 2/4885MEN1 881/4885KMT2A 3249/4885
US-20240156808-A1 Compositions and methods to improve the therapeutic benefit of suboptimally chemical compounds and biological therapies including substituted camptothecins such as irinotecan and topotecan for the treatment of benign and neoplastic hyperproliferative disease conditions, infections, inflammatory and immunological diseases TOP2A, TOP2B, TOP1 TOP1 3/4885MEN1 601/4885KMT2A 1727/4885
US-20140194458-A1 DERIVATE, PREPARATION METHOD AND USE OF 10-METHOXYCAMPTOTHECINE MGMT, TOP1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 TOP1 2/4885MEN1 38/4885KMT2A 1457/4885

“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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