SCHEMBL1442847

SCHEMBL1442847

Nc1nc(-c2ccccn2)nc(Cl)c1Cc1ccccc1F

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.83
L3MBTL1 Q9Y468 5/20 0.83
RAB9A P51151 4/20 0.83
HTT P42858 3/20 0.83
ALDH1A1 P00352 2/20 0.83
SMN1; SMN2 Q16637 4/20 0.65
TDP1 Q9NUW8 3/20 0.65
PPP1CA P62136 2/20 0.65
LMNA P02545 2/20 0.58
MAPT P10636 1/20 0.58
METAP1 P53582 2/20 0.44
KDM4E B2RXH2 2/20 0.43
ALOX15 P16050 1/20 0.43
ADORA2A P29274 3/20 0.40
ADORA1 P30542 2/20 0.40
FFAR1 O14842 2/20 0.38
METAP2 P50579 1/20 0.38
HPGD P15428 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 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
SCHEMBL1442410 0.91 NPC1 (0.71) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL11901245 0.91 NPC1 (1.00) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1443051 0.85 NPC1 (0.60) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1443818 0.82 NPC1 (0.56) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1442903 0.79 L3MBTL1 (0.72) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1443230 0.79 L3MBTL1 (0.76) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1442705 0.78 L3MBTL1 (0.56) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1443823 0.78 NPC1 (0.71) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1443003 0.77 L3MBTL1 (0.68) NPC1L3MBTL1RAB9AHTTALDH1A1
SCHEMBL1442628 0.75 L3MBTL1 (0.50) NPC1L3MBTL1RAB9AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2473486-B2 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2021-09-22 EP disclosed
EP-2473486-B2 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2021-09-22 EP disclosed
EP-2473486-B1 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2015-10-28 EP disclosed
EP-2473486-B1 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2015-10-28 EP disclosed
US-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-09 US disclosed
US-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-09 US disclosed
US-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-09 US disclosed
EP-2473486-A1 NOVEL PYRIMIDINE AND TRIAZINE HEPCIDINE ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2012-07-11 EP disclosed
WO-2011026835-A1 NOVEL PYRIMIDINE AND TRIAZINE HEPCIDINE ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2011-03-10 WO disclosed
WO-2011026835-A1 NOVEL PYRIMIDINE AND TRIAZINE HEPCIDINE ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2011-03-10 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 (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-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists HAMP, DHPS, SLC40A1 NPC1 2222/4885L3MBTL1 3829/4885RAB9A 3522/4885

“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.