SCHEMBL4283979

SCHEMBL4283979

CCN1CCCC1CNC(=O)c1ccc(N)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.70
ABCG2 Q9UNQ0 1/20 0.61
MCHR2 Q969V1 1/20 0.61
MCHR1 Q99705 1/20 0.61
DRD2 P14416 4/20 0.59
TSHR P16473 1/20 0.57
ALDH1A1 P00352 1/20 0.57
GAA P10253 1/20 0.57
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL10195010 0.88 HSD17B10 (0.68) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL10195728 0.88 HSD17B10 (0.68) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL10195730 0.88 HSD17B10 (0.68) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL9367355 0.87 HSD17B10 (0.67) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL11919266 0.87 DRD2 (0.67) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL4341169 0.87 MCHR1 (0.69) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL11916163 0.86 HSD17B10 (0.65) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL15317635 0.86 HSD17B10 (0.65) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL15317637 0.86 HSD17B10 (0.65) HSD17B10ABCG2MCHR2MCHR1DRD2
SCHEMBL4572920 0.85 DRD2 (0.60) HSD17B10ABCG2MCHR2MCHR1DRD2

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
CN-101981036-B Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2013-09-04 CN disclosed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
CN-101981036-A Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2011-02-23 CN disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 HSD17B10 3045/4885ABCG2 771/4885MCHR2 2636/4885

“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.