SCHEMBL3577145

SCHEMBL3577145

CN1CCN(c2cc(-c3cn[nH]c3N)cc(N3CCN(C)CC3)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.48
MAPT P10636 4/20 0.48
LMNA P02545 1/20 0.42
JAK2 O60674 1/20 0.42
KDM4E B2RXH2 3/20 0.41
HRH4 Q9H3N8 2/20 0.41
ADRA2C P18825 2/20 0.41
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
PTK2B Q14289 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GFER P55789 1/20 0.40
KMT2A Q03164 1/20 0.40
ESR2 Q92731 1/20 0.40
FYN P06241 2/20 0.40
RPS6KA3 P51812 1/20 0.39
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3580409 0.86 ADRA2C (0.54) GAAMAPTLMNAJAK2KDM4E
SCHEMBL3588113 0.85 MAPT (0.51) GAAMAPTLMNAJAK2KDM4E
SCHEMBL4170081 0.76 ALDH1A1 (0.51) LMNAJAK2ADRA2CALDH1A1RPS6KA3
SCHEMBL4169163 0.75 GAA (0.59) GAAMAPTKDM4EPTK2BALDH1A1
SCHEMBL4171966 0.75 KDM4E (0.50) GAAKDM4EHRH4ALDH1A1GFER
SCHEMBL3594899 0.74 HRH3 (0.44) GAAMAPTLMNAJAK2KDM4E
SCHEMBL3588930 0.71 LMNA (0.56) MAPTLMNA
SCHEMBL4167689 0.71 LMNA (0.48) LMNAKDM4EALDH1A1KMT2AROCK2
SCHEMBL4754710 0.70 LMNA (0.50) GAAMAPTLMNAKDM4E
SCHEMBL3577966 0.70 LMNA (0.46) GAAMAPTLMNAKDM4EGFER

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 US disclosed
EP-2074127-A1 PYRAZOLO [1, 5-A]PYRIMIDINE DERIVATIVES AND THEIR THERAPEUTIC USE Novartis AG (CH) 2009-07-01 EP disclosed
WO-2008037459-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AND THEIR THERAPEUTIC USE NOVARTIS AG (CH) 2008-04-03 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN GAA 3549/4885MAPT 2260/4885LMNA 4677/4885

“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.