SCHEMBL973527

SCHEMBL973527

Cc1ccc2nc(-c3ccc(Br)cc3)cn2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 13/20 1.00
RAB9A P51151 12/20 1.00
APP P05067 5/20 1.00
PAX8 Q06710 2/20 1.00
KDM4E B2RXH2 11/20 0.80
ALDH1A1 P00352 9/20 0.80
SMN1; SMN2 Q16637 8/20 0.80
KMT2A Q03164 2/20 0.80
MEN1 O00255 1/20 0.80
MITF O75030 1/20 0.80
KDM5A P29375 1/20 0.80
KDM5C P41229 1/20 0.80
HPGD P15428 5/20 0.68
PKM P14618 4/20 0.68
TP53 P04637 2/20 0.68
HSD17B10 Q99714 2/20 0.68
TSHR P16473 1/20 0.68
CDK5 Q00535 1/20 0.68
CDK5R1 Q15078 1/20 0.68
POLB P06746 3/20 0.61

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
SCHEMBL1473062 0.90 NPC1 (0.81) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL396368 0.89 NPC1 (1.00) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL7605200 0.87 NPC1 (0.77) NPC1RAB9AAPPPAX8KDM4E
Bromide SCHEMBL1691457 0.86 NPC1 (0.75) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL1691254 0.83 NPC1 (0.80) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL1983316 0.83 NPC1 (0.80) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL13325747 0.83 NPC1 (0.90) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL1691890 0.83 ALDH1A3 (0.82) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL21708016 0.83 NPC1 (0.80) NPC1RAB9AAPPPAX8KDM4E
SCHEMBL10120370 0.83 NPC1 (0.80) NPC1RAB9AAPPPAX8KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine UNIVERSITY OF HEIDELBERG (DE) 2020-02-27 US claimed
EP-3611256-A1 APPLICATION OF IMIDAZOPYRIDINE DERIVATIVES IN REGENERATIVE MEDICINE Universität Heidelberg (DE) 2020-02-19 EP claimed
US-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine UNIVERSITY OF HEIDELBERG (DE) 2020-02-27 US disclosed
US-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine UNIVERSITY OF HEIDELBERG (DE) 2020-02-27 US disclosed
EP-3611256-A1 APPLICATION OF IMIDAZOPYRIDINE DERIVATIVES IN REGENERATIVE MEDICINE Universität Heidelberg (DE) 2020-02-19 EP disclosed
EP-3611256-A1 APPLICATION OF IMIDAZOPYRIDINE DERIVATIVES IN REGENERATIVE MEDICINE Universität Heidelberg (DE) 2020-02-19 EP disclosed
US-7867629-B2 Nitrogenous heterocyclic derivative and organic electroluminescent element employing the same IDEMITSU KOSAN CO., LTD. (JP) 2011-01-11 US disclosed
WO-2007039146-A1 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-12 WO disclosed
US-5204352-A 5-Guanylhydrazonylphenyl-2,3-alkyleneimidazol-1-ium and derivatives; Trypanosoma THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1993-04-20 US 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 (1 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-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine DOT1L, NSD1, KDM3A NPC1 4209/4885RAB9A 3350/4885APP 4843/4885

“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.