SCHEMBL3396309

SCHEMBL3396309

CC1CN(Cc2ccc(N)cc2)CC(C)N1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
ALDH1A1 P00352 2/20 0.50
GBA1 P04062 1/20 0.49
HRH3 Q9Y5N1 3/20 0.47
HRH4 Q9H3N8 1/20 0.47
MLNR O43193 11/20 0.44
CYP3A4 P08684 6/20 0.44
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL3396312 1.00 LMNA (0.51) LMNAALDH1A1GBA1HRH3HRH4
SCHEMBL20803929 0.83 MLNR (0.47) LMNAALDH1A1HRH3HRH4MLNR
SCHEMBL5059571 0.82 MLNR (0.56) HRH3HRH4MLNRCYP3A4SIGMAR1
SCHEMBL5059568 0.82 MLNR (0.56) HRH3HRH4MLNRCYP3A4SIGMAR1
SCHEMBL12499778 0.82 SIGMAR1 (0.48) ALDH1A1HRH3HRH4MLNRCYP3A4
SCHEMBL3522693 0.81 FUCA1 (0.55) LMNAALDH1A1GBA1MLNRCYP3A4
SCHEMBL3522692 0.81 FUCA1 (0.55) LMNAALDH1A1GBA1MLNRCYP3A4
SCHEMBL3324661 0.81 FUCA1 (0.55) LMNAALDH1A1GBA1MLNRCYP3A4
SCHEMBL4279682 0.81 FUCA1 (0.55) LMNAALDH1A1GBA1MLNRCYP3A4
SCHEMBL15651766 0.81 LMNA (0.51) LMNAALDH1A1MLNRCYP3A4

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
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
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 LMNA 3429/4885ALDH1A1 1389/4885GBA1 826/4885

“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.