SCHEMBL10179327

SCHEMBL10179327

Nc1ccc(C(=O)Nc2ccc(-c3ccc4ncc(N5CCN(Cc6cccnc6)CC5)nc4c3)cc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 1/20 0.50
HIF1A Q16665 5/20 0.49
EPAS1 Q99814 5/20 0.49
ABCB1 P08183 2/20 0.46
CYP3A4 P08684 2/20 0.46
MCHR1 Q99705 5/20 0.44
HTR2C P28335 4/20 0.44
CXCR4 P61073 1/20 0.43
WNT1 P04628 1/20 0.42
DYRK1A Q13627 1/20 0.42
ABL1 P00519 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL12811966 0.92 HIF1A (0.53) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL10179606 0.92 SMN1; SMN2 (0.59) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL1442483 0.90 MAPT (0.58) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL10179384 0.90 HIF1A (0.55) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL1441991 0.89 HIF1A (0.53) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL12812054 0.89 MAPT (0.51) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL1442629 0.89 HIF1A (0.55) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL10180943 0.89 MAPT (0.53) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL10179566 0.88 HIF1A (0.67) MAPTSMN1; SMN2MAPK1HIF1AEPAS1
SCHEMBL10179276 0.87 HIF1A (0.55) MAPTSMN1; SMN2MAPK1HIF1AEPAS1

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-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 US claimed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 US claimed
CN-102596932-A Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER SCHERING PHARMA AG 2012-07-18 CN claimed
EP-2473498-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2012-07-11 EP claimed
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 US disclosed
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 US disclosed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 US disclosed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 US disclosed
WO-2011026579-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 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-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS ABL1, TYK2, JAK2 MAPT 1296/4885SMN1; SMN2 2189/4885MAPK1 195/4885

“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.