SCHEMBL3399366

SCHEMBL3399366

CN1CCN(C(=O)c2c(F)cc(Br)cc2F)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
POLB P06746 2/20 0.49
HRH4 Q9H3N8 12/20 0.48
HRH3 Q9Y5N1 1/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL16151062 0.85 LMNA (0.46) MEN1KMT2ALMNATSHRHTT
SCHEMBL3396285 0.82 LMNA (0.44) MEN1KMT2ALMNATSHRHTT
SCHEMBL3396292 0.82 LMNA (0.44) MEN1KMT2ALMNATSHRHTT
SCHEMBL28506200 0.81 POLB (0.50) MEN1KMT2APOLBHRH4HRH3
SCHEMBL2931560 0.80 TSHR (0.54) KMT2APOLBLMNATSHRHTT
SCHEMBL1447852 0.80 CPS1 (0.56) MEN1KMT2APOLBHRH4HRH3
SCHEMBL18390530 0.79 LMNA (0.71) MEN1KMT2APOLBHRH4LMNA
SCHEMBL16155915 0.79 MEN1 (0.47) MEN1KMT2APOLBLMNA
SCHEMBL31403224 0.78 KMT2A (0.55) MEN1KMT2APOLBHRH4HRH3
SCHEMBL24381981 0.76 KDM4E (0.47) MEN1KMT2APOLBHRH4LMNA

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-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
EP-2247591-A1 PYRROLO [2, 3-D]PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS Novartis AG (CH) 2010-11-10 EP disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US disclosed
WO-2009098236-A1 PYRROLO [2, 3-D] PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 MEN1 246/4885KMT2A 1885/4885POLB 4649/4885

“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.