SCHEMBL21708019

SCHEMBL21708019

Cc1ccccc1Nc1nc(C(C)(C)C)cs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 12/20 1.00
NPC1 O15118 6/20 0.52
RAB9A P51151 6/20 0.52
POLB P06746 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
TP53 P04637 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPK1 P28482 2/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL14433276 0.88 CCR4 (1.00) CCR4NPC1RAB9APOLBTDP1
SCHEMBL29274298 0.86 CCR4 (0.76) CCR4NPC1RAB9APOLBTDP1
SCHEMBL21708011 0.83 CCR4 (0.71) CCR4NPC1RAB9APOLBSMN1; SMN2
SCHEMBL14433284 0.82 CCR4 (1.00) CCR4ALDH1A1GAAMAPT
SCHEMBL14433280 0.80 CCR4 (0.75) CCR4NPC1RAB9APOLBSMN1; SMN2
SCHEMBL5486145 0.79 CCR4 (1.00) CCR4NPC1RAB9APOLBSMN1; SMN2
SCHEMBL14433279 0.76 CCR4 (1.00) CCR4ALDH1A1
SCHEMBL1135765 0.76 CCR4 (0.61) CCR4MAPK1ALDH1A1GAAMAPT
SCHEMBL14433277 0.76 CCR4 (0.69) CCR4NPC1RAB9APOLBSMN1; SMN2
SCHEMBL21708025 0.76 CCR4 (0.76) CCR4NPC1RAB9ASMN1; SMN2TP53

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 4 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 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

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 CCR4 3403/4885NPC1 4209/4885RAB9A 3350/4885

“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.