SCHEMBL3399449

SCHEMBL3399449

Cc1ccc(N)cc1C(=O)N1CCN(C)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.53
POLB P06746 2/20 0.52
TP53 P04637 2/20 0.50
LMNA P02545 2/20 0.50
TSHR P16473 2/20 0.50
ALOX15 P16050 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.47
HSP90AA1 P07900 1/20 0.47
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL31173086 1.00 HRH4 (0.53) HRH4POLBTP53LMNATSHR
SCHEMBL31202952 0.88 HRH4 (0.53) HRH4POLBTP53LMNATSHR
SCHEMBL3426385 0.88 HRH4 (0.53) HRH4POLBTP53LMNATSHR
SCHEMBL17774812 0.87 HPGD (0.55) TSHRALOX15L3MBTL1HTTALDH1A1
SCHEMBL10126592 0.86 HPGD (0.54) POLBTSHRALOX15L3MBTL1HTT
SCHEMBL29451263 0.86 HPGD (0.54) POLBTSHRALOX15L3MBTL1HTT
SCHEMBL17774891 0.84 HSP90AA1 (0.57) HRH4POLBTP53LMNATSHR
SCHEMBL13503857 0.84 POLB (0.61) HRH4POLBTP53LMNATSHR
SCHEMBL3400169 0.83 MEN1 (0.57) HRH4POLBTP53LMNATSHR
SCHEMBL17979877 0.83 MEN1 (0.55) TSHRHTTALDH1A1HPGDKMT2A

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 5 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
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 HRH4 994/4885POLB 4649/4885TP53 344/4885

“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.