SCHEMBL6431346

SCHEMBL6431346

CCOC(=O)c1c(CCl)c2cc3c(cc2[nH]c1=O)OCCO3

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HSD17B10 Q99714 1/20 0.51
TSHR P16473 1/20 0.44
ALDH1A1 P00352 4/20 0.43
PKM P14618 1/20 0.43
KDM4E B2RXH2 3/20 0.42
CSF1R P07333 1/20 0.42
KDM5A P29375 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
NPC1 O15118 1/20 0.39
ALPL P05186 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL5860089 0.80 ALDH1A1 (0.49) MAPTMEN1KMT2AALDH1A1PKM
SCHEMBL5860143 0.77 LMNA (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL5860068 0.75 TOP1 (0.43) MAPTMEN1KMT2AHSD17B10ALDH1A1
SCHEMBL8805110 0.67 ALDH1A1 (0.51) MAPTMEN1KMT2AHSD17B10TSHR
SCHEMBL7818198 0.67 TSHR (0.66) MAPTMEN1KMT2AHSD17B10TSHR
SCHEMBL6295988 0.67 ALDH1A1 (0.55) MAPTMEN1KMT2AHSD17B10TSHR
SCHEMBL5859825 0.67 LMNA (0.50) MAPTALDH1A1PKMKDM4EKDM5A
SCHEMBL13739817 0.66 CSF1R (0.52) MAPTMEN1KMT2AHSD17B10TSHR
SCHEMBL12492331 0.66 KDM5A (0.54) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL8142770 0.65 KDM5A (0.62) KDM5AKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1254908-B9 Preparation of a camptothecin derivative by intramolecular cyclisation OSI PHARM INC (US) 2005-09-21 EP disclosed
EP-1254908-B1 Preparation of a camptothecin derivative by intramolecular cyclisation OSI PHARM INC (US) 2005-02-23 EP disclosed
US-6821982-B2 Preparation of a camptothecin derivative by intramolecular cyclisation OSI PHARMACEUTICALS, INC. 2004-11-23 US disclosed
EP-0758333-B1 INTERMEDIATES IN PHARMACEUTICAL CAMPTOTHECIN PREPARATION OSI PHARM INC (US) 2004-03-03 EP disclosed
US-20030204088-A1 Preparation of a camptothecin derivative by intramolecular cyclisation OSI PHARMACEUTICALS, INC. 2003-10-30 US disclosed
US-6559309-B2 Preparation for camptothecin and camptothecin-like compounds and to novel intermediates used in this preparation. The process for the preparation of the camptothecin derivative known by 7-(4 OSI PHARMACEUTICALS, INC. 2003-05-06 US disclosed
US-20030045719-A1 Preparation of a camptothecin derivative by intramolecular cyclisation OSI PHARMACEUTICALS, INC. 2003-03-06 US disclosed
EP-1254908-A1 Preparation of a camptothecin derivative by intramolecular cyclisation GILEAD SCIENCES, INC. (US) 2002-11-06 EP disclosed
EP-0758335-B1 PREPARATION OF A CAMPTOTHECIN DERIVATIVE BY INTRAMOLECULAR CYCLISATION GILEAD SCIENCES INC (US) 2002-11-06 EP disclosed
US-6462196-B1 NOVEL INTERMEDIATES USED IN THE PREPARATION OF CAMPTOTHECIN DERIVATIVES OSI PHARMACEUTICALS, INC. 2002-10-08 US disclosed
US-6063923-A Preparation of a camptothecin derivative by intramolecular cyclisation GLAXO WELLCOME INC. (US) 2000-05-16 US disclosed
EP-0758333-A1 INTERMEDIATES IN PHARMACEUTICAL CAMPTOTHECIN PREPARATION GLAXO WELLCOME INC. (US) 1997-02-19 EP disclosed
WO-1995029917-A2 INTERMEDIATES IN PHARMACEUTICAL CAMPTOTHECIN PREPARATION GLAXO WELLCOME INC. (US) 1995-11-09 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-20030204088-A1 Preparation of a camptothecin derivative by intramolecular cyclisation TOP1, TOP2A, TOP2B MAPT 4732/4885MEN1 209/4885KMT2A 3974/4885
US-20030045719-A1 Preparation of a camptothecin derivative by intramolecular cyclisation TOP1, TOP2A, TOP2B MAPT 4679/4885MEN1 294/4885KMT2A 3970/4885

“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.