SCHEMBL3311902

SCHEMBL3311902

OCCN1CC2CNCC(C1)O2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
PIK3CD O00329 1/20 0.31

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
SCHEMBL21772273 0.82 KDM4E (0.38) KDM4EALDH1A1MAPTKMT2APIK3CD
SCHEMBL20745279 0.80 PIK3CD (0.48) KDM4EALDH1A1MAPTKMT2APIK3CD
SCHEMBL24505430 0.76 CHRNB2 (0.41) MAPTKMT2A
SCHEMBL3315860 0.75 KDM4E (0.33) KDM4EALDH1A1PIK3CD
SCHEMBL3127669 0.74 AVPR1A (0.34) KMT2A
SCHEMBL3723198 0.74 PIK3CD (0.38) PIK3CD
SCHEMBL6738562 0.72 CHRNB2 (0.44)
SCHEMBL2333679 0.71
SCHEMBL3728955 0.70
SCHEMBL24975368 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS KDM4E 2169/4885ALDH1A1 649/4885MAPT 2130/4885

“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.