SCHEMBL864188

SCHEMBL864188

Cc1cc(N[C@@H](C)c2cc3cccc(Cl)c3nc2NCCO)n2ncnc2n1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 5/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 2/20 0.42
HTT P42858 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
HIF1A Q16665 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL864189 1.00 MAPK1 (0.43) MAPK1ALDH1A1LMNAGAAHTT
SCHEMBL18035867 0.88 ALDH1A1 (0.44) MAPK1ALDH1A1LMNAGAAHTT
SCHEMBL863594 0.79 KCNN3 (0.38)
SCHEMBL863593 0.79 KCNN3 (0.38)
SCHEMBL864328 0.77 MAP4K4 (0.46)
SCHEMBL864327 0.77 MAP4K4 (0.46)
SCHEMBL864024 0.75 PIK3CD (0.45) MAPK1LMNAKMT2ASMN1; SMN2
SCHEMBL864025 0.75 PIK3CD (0.45) MAPK1LMNAKMT2ASMN1; SMN2
SCHEMBL864803 0.73 PIK3CD (0.49)
SCHEMBL864804 0.73 PIK3CD (0.49)

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
EP-2396315-B1 QUINOLINE DERIVATIVES AS PI3K KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-08-31 EP disclosed
US-8513284-B2 Fused pyridine and pyrazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2013-08-20 US disclosed
US-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors UCB PHARMA S.A. (BE) 2012-03-29 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-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors PDPK1, PDXK, PIK3CA MAPK1 96/4885ALDH1A1 3850/4885LMNA 4619/4885

“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.