SCHEMBL1864060

SCHEMBL1864060

C1=CC2=Cc3ccccc3C2=N1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.38

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
SCHEMBL30493712 1.00 ABCG2 (0.38) ABCG2
Hydrochloric Acid SCHEMBL7340960 0.98 ABCG2 (0.37) ABCG2
SCHEMBL3647981 0.85 ABCG2 (0.34) ABCG2
SCHEMBL3378055 0.73 ABCG2 (0.37) ABCG2
SCHEMBL8987959 0.68 ABCG2 (0.33) ABCG2
SCHEMBL1870999 0.67 ABCG2 (0.38) ABCG2
SCHEMBL4555851 0.62 IDO1 (0.37)
SCHEMBL30019213 0.62 ABCG2 (0.62) ABCG2
SCHEMBL261676 0.62 ABCG2 (0.62) ABCG2
SCHEMBL1881126 0.60 ABCG2 (0.32) ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130189373-A1 Method of Treating Cancer Using Combination of a Bifunctional Alkylating Agent and DNA Repair Inhibitors Academai Sinica (TW) 2013-07-25 US claimed
WO-2011056663-A1 METHOD OF TREATING CANCER USING COMBINATION OF A BIFUNCTIONAL ALKYLATING AGENT AND DNA REPAIR INHIBITORS ACADEMIA SINICA (TW) 2011-05-12 WO claimed
EP-0118566-B1 INDENO[1,2-b]PYRROLE DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1987-03-04 EP claimed
US-4578397-A ANTICONVULSANTS, ANTIEPILEPTIC AGENTS, ANTIANXIETY AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1986-03-25 US claimed
EP-0118566-A1 INDENO[1,2-b]PYRROLE DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-09-19 EP claimed
JP-59046269-A None JP disclosed
EP-3860712-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN Vertex Pharmaceuticals Incorporated (US) 2021-08-11 EP disclosed
WO-2020081257-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-04-23 WO disclosed
US-8772284-B2 Method of treating cancer using combination of a bifunctional alkylating agent and DNA repair inhibitors ACADEMIA SINICA (TW) 2014-07-08 US disclosed
US-8703951-B2 Synthesis of 4H-benzo[D]pyrrolo[1,2-A]thiazoles and indolizino[6,7-b]indole derivatives and their use as antitumor therapeutic agents ACADEMIA SINICA (TW) 2014-04-22 US disclosed
US-20130189373-A1 Method of Treating Cancer Using Combination of a Bifunctional Alkylating Agent and DNA Repair Inhibitors Academai Sinica (TW) 2013-07-25 US disclosed
US-20130178629-A1 SYNTHESIS OF 4H-BENZO[D]PYRROLO[1,2-A]THIAZOLES AND INDOLIZINO[6,7-b]INDOLE DERIVATIVES AND THEIR USE AS ANTITUMOR THERAPEUTIC AGENTS ACADEMIA SINICA (TW) 2013-07-11 US disclosed
US-5574060-A INDANOPYRROLES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-11-12 US disclosed
EP-0713484-A1 INHIBITORS OF BIOGENIC AMINE TRANSPORTERS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-05-29 EP disclosed
WO-1995005364-A2 INHIBITORS OF BIOGENIC AMINE TRANSPORTERS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-02-23 WO disclosed
EP-0569457-A1 USE OF THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES. BOEHRINGER MANNHEIM GMBH (DE) 1993-11-18 EP disclosed
US-4578397-A ANTICONVULSANTS, ANTIEPILEPTIC AGENTS, ANTIANXIETY AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1986-03-25 US disclosed
US-4578397-A ANTICONVULSANTS, ANTIEPILEPTIC AGENTS, ANTIANXIETY AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1986-03-25 US disclosed
EP-0118566-A1 INDENO[1,2-b]PYRROLE DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-09-19 EP disclosed
JP-S5946269-A INDENO(1,2-B)PYRROLE DERIVATIVE YOSHITOMI PHARMACEUT IND LTD 1984-03-15 JP 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-20130178629-A1 SYNTHESIS OF 4H-BENZO[D]PYRROLO[1,2-A]THIAZOLES AND INDOLIZINO[6,7-b]INDOLE DERIVATIVES AND THEIR USE AS ANTITUMOR THERAPEUTIC AGENTS TOP2B, BRD4, MCL1 ABCG2 468/4885
US-20130189373-A1 Method of Treating Cancer Using Combination of a Bifunctional Alkylating Agent and DNA Repair Inhibitors TOP2A, UNG, MRE11 ABCG2 394/4885

“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.