Gimatecan

Gimatecan

SCHEMBL130586

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1ccccc1c2C=NOC(C)(C)C

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TOP1

The experimentally established mechanism targets of Gimatecan. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 known ✓ P11387 19/20 0.79
ALDH1A1 P00352 3/20 0.63
GLA P06280 3/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
RECQL P46063 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
KDM4E B2RXH2 2/20 0.62
TP53 P04637 2/20 0.62
HPGD P15428 2/20 0.62
STAT6 P42226 1/20 0.62
CHEK1 O14757 1/20 0.62
HDAC3 O15379 1/20 0.62
ABCC4 O15439 1/20 0.62
GMNN O75496 1/20 0.62
LMNA P02545 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
HNRNPA1 P09651 1/20 0.62

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
Gimatecan SCHEMBL24685122 1.00 TOP1 (0.79) TOP1ALDH1A1GLAMEN1KMT2A
Gimatecan SCHEMBL15341182 1.00 TOP1 (0.79) TOP1ALDH1A1GLAMEN1KMT2A
Gimatecan SCHEMBL1649254 1.00 TOP1 (0.79) TOP1ALDH1A1GLAMEN1KMT2A
Gimatecan SCHEMBL27721325 1.00 TOP1 (0.79) TOP1ALDH1A1GLAMEN1KMT2A
Gimatecan SCHEMBL29358288 1.00 TOP1 (0.79) TOP1ALDH1A1GLAMEN1KMT2A
SCHEMBL3181051 0.93 TOP1 (0.76) TOP1ALDH1A1GLAMEN1KMT2A
SCHEMBL25932531 0.92 TOP1 (0.68) TOP1ALDH1A1GLAMEN1KMT2A
SCHEMBL22843988 0.92 TOP1 (0.81) TOP1ALDH1A1GLAMEN1KMT2A
SCHEMBL2028767 0.92 TOP1 (0.81) TOP1ALDH1A1GLAMEN1KMT2A
SCHEMBL2028388 0.92 TOP1 (0.85) TOP1ALDH1A1GLAMEN1KMT2A

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 172 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814520-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING A CAMTOTHECIN DERIVATE SIGMA TAU IND FARMACEUTI (IT) 2016-04-13 EP claimed
EP-1759699-B1 LIPOSOME PREPARATION CONTAINING SLIGHTLY WATER-SOLUBLE CAMPTOTHECIN YAKULT HONSHA KK (JP) 2016-01-20 EP claimed
US-8975248-B2 Combinations of therapeutic agents for treating cancer SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2015-03-10 US claimed
US-8518961-B2 spontaneously dispersible; 7-t-butoxyiminomethylcamptothecin in microemulsion preconcentrate; topoisomerase I inhibitor; proliferative diseases including cancer; stability; bioavailability SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2013-08-27 US claimed
EP-1915153-B1 IMMEDIATE RELEASE THERAPEUTIC SYSTEMS FOR IMPROVED ORAL ABSORPTION OF 7-[(E)-TERT-BUTYLOXYIMINOMETHYL]CAMTOTHECIN SIGMA TAU IND FARMACEUTI (IT) 2013-04-10 EP claimed
EP-2515898-A1 ANTICANCER COMBINATION OF ARTEMISININ-BASED DRUGS AND OTHER CHEMOTHERAPEUTIC AGENTS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2012-10-31 EP claimed
EP-1828196-B1 STEREOSELECTIVE PROCESS AND CRYSTALLINE FORMS OF A CAMPTOTHECIN SIGMA TAU IND FARMACEUTI (IT) 2012-10-17 EP claimed
US-20120258181-A1 ANTICANCER COMBINATION OF ARTEMISININ-BASED DRUGS AND OTHER CHEMOTHERAPEUTIC AGENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2012-10-11 US claimed
US-20120093809-A1 USE OF ALKANOYL L-CARNITINE IN COMBINATION WITH CHEMOTHERAPEUTIC AGENTS FOR THE TREATMENT OF NEOPLASMS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2012-04-19 US claimed
US-8124769-B2 Stereoselective process and crystalline forms of a camptothecin SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2012-02-28 US claimed
WO-2006065780-A2 COMBINATIONS OF THERAPEUTIC AGENTS FOR TREATING CANCER NOVARTIS AG (CH) 2006-06-22 WO claimed
WO-2006053755-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A CAMTOTHECIN DERIVATE NOVARTIS AG (CH) 2006-05-26 WO claimed
WO-2005120643-A2 USE OF 7-T-BUTOXYIMINOMETHYLCAMPTOTHECIN FOR TREATING UTERINE NEOPLASMS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-12-22 WO claimed
WO-2005110486-A2 7-T-BUTOXYIMINOMETHYLCAMPTOTHECIN CONJUGATED IN POSITION 20 WITH INTEGRIN ANTAGONISTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-11-24 WO claimed
US-20040018988-A1 Camptothecin derivatives having antitumor activity SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2004-01-29 US claimed
EP-1044977-B1 Camptothecin derivatives having antitumor activity SIGMA TAU IND FARMACEUTI (IT) 2002-05-02 EP claimed
US-20010008939-A1 Camptothecin derivatives having antitumor activity SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A.. 2001-07-19 US claimed
US-6242457-B1 OXIME DERIVATIVES SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2001-06-05 US claimed
EP-1044977-A1 Camptothecin derivatives having antitumor activity Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2000-10-18 EP claimed
WO-2000053607-A1 CAMPTOTHECIN DERIVATIVES HAVING ANTITUMOR ACTIVITY SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2000-09-14 WO claimed

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-20010008939-A1 Camptothecin derivatives having antitumor activity TOP1, TOP2A, TYMP TOP1 1/4885ALDH1A1 2202/4885GLA 1623/4885
US-20040018988-A1 Camptothecin derivatives having antitumor activity TOP1, TOP2A, TOP2B TOP1 1/4885ALDH1A1 1248/4885GLA 1972/4885

“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.