SCHEMBL17801957

SCHEMBL17801957

CN(C)CCOc1ccc2[nH]c(C(=O)N3C[C@@H](CCl)c4c3cc(O)c3ccccc43)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 7/20 0.51
PDGFRA P16234 6/20 0.51
ADH1A P07327 1/20 0.48
KIT P10721 1/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
ABL2 P42684 1/20 0.48
FLT3 P36888 2/20 0.45
DRD3 P35462 5/20 0.39
DRD2 P14416 4/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
BCHE P06276 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL13596672 1.00 PDGFRB (0.51) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL6390745 0.92 PDGFRB (0.47) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL8113421 0.92 PDGFRB (0.51) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL6521167 0.91 ADH1A (0.50) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL6518434 0.91 ADH1A (0.52) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL6518437 0.91 ADH1A (0.52) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL6521161 0.91 ADH1A (0.50) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL12795535 0.90 PDGFRB (0.46) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL19266907 0.90 PDGFRB (0.46) PDGFRBPDGFRAADH1AKITFLT1
SCHEMBL24455433 0.90 PDGFRB (0.49) PDGFRBPDGFRAADH1AKITFLT1

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-3226909-B1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH INC (US) 2026-04-15 EP disclosed
WO-2022109335-A1 GLYCOSIDE DUAL-CLEAVAGE LINKERS FOR ANTIBODY-DRUG CONJUGATES R.P. SCHERER TECHNOLOGIES, LLC (US) 2022-05-27 WO disclosed
US-20210369705-A1 COMBINATION THERAPY UTILIZING DNA ALKYLATING AGENTS AND ATR INHIBITORS MERCK PATENT GMBH (DE) 2021-12-02 US disclosed
WO-2020154437-A1 GLYCOSIDE-CONTAINING PEPTIDE LINKERS FOR ANTIBODY-DRUG CONJUGATES R.P. SCHERER TECHNOLOGIES, LLC (US) 2020-07-30 WO disclosed
US-20200087297-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2020-03-19 US disclosed
US-20200087297-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2020-03-19 US disclosed
US-10556895-B2 Quaternary amine compounds and antibody-drug conjugates thereof GENENTECH, INC. (US) 2020-02-11 US disclosed
WO-2018031448-A1 NEAR-IR LIGHT-CLEAVABLE CONJUGATES AND CONJUGATE PRECURSORS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2018-02-15 WO disclosed
EP-3226909-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF Genentech, Inc. (US) 2017-10-11 EP disclosed
US-20170232113-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2017-08-17 US disclosed
WO-2017027721-A1 NEAR-IR LIGHT-CLEAVABLE CONJUGATES AND CONJUGATE PRECURSORS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2017-02-16 WO disclosed
WO-2016090050-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2016-06-09 WO disclosed
WO-2016090050-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2016-06-09 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 (4 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-20210369705-A1 COMBINATION THERAPY UTILIZING DNA ALKYLATING AGENTS AND ATR INHIBITORS ATR, TOP2A, TOP1 PDGFRB 1063/4885PDGFRA 898/4885ADH1A 3241/4885
US-20170232113-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF H1-5, H1-4, CD47 PDGFRB 1287/4885PDGFRA 1209/4885ADH1A 1665/4885
US-10556895-B2 Quaternary amine compounds and antibody-drug conjugates thereof H1-5, H1-4, CD47 PDGFRB 1287/4885PDGFRA 1209/4885ADH1A 1665/4885
US-20200087297-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF H1-5, H1-4, CD47 PDGFRB 1287/4885PDGFRA 1209/4885ADH1A 1665/4885

“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.