SCHEMBL17849281

SCHEMBL17849281

Cc1cncc2cc(-c3cnc4ccc(N[C@H]5CC[C@H](C)CC5)nn34)sc12

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.48
PIM1 P11309 14/20 0.47
FYN P06241 4/20 0.46
KCNH2 Q12809 2/20 0.46
PIM3 Q86V86 1/20 0.43
PIM2 Q9P1W9 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
SCHEMBL17849311 1.00 MKNK1 (0.48) MKNK1PIM1FYNKCNH2PIM3
SCHEMBL17849280 0.93 PIM1 (0.55) MKNK1PIM1FYNKCNH2
SCHEMBL16009051 0.93 PIM1 (0.55) MKNK1PIM1FYNKCNH2
SCHEMBL16009050 0.93 PIM1 (0.55) MKNK1PIM1FYNKCNH2
SCHEMBL16023615 0.90 PIM1 (0.58) MKNK1PIM1FYNKCNH2
SCHEMBL17849308 0.89 PIM1 (0.51) MKNK1PIM1FYNKCNH2PIM3
SCHEMBL17849277 0.88 FYN (0.52) MKNK1PIM1FYNKCNH2
SCHEMBL18015050 0.88 FYN (0.52) MKNK1PIM1FYNKCNH2
SCHEMBL17849307 0.85 PIM1 (0.47) MKNK1PIM1FYNKCNH2PIM3
SCHEMBL16017059 0.81 FYN (0.53) MKNK1PIM1FYNKCNH2

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
US-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS Califia Bio, Inc. 2016-08-11 US disclosed
US-9370515-B2 Mixed lineage kinase inhibitors and method of treatments Califia Bio, Inc. (US) 2016-06-21 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-20160228437-A1 MIXED LINEAGE KINASE INHIBITORS AND METHOD OF TREATMENTS MAP3K2, MAP3K1, MAP3K20 MKNK1 49/4885PIM1 363/4885FYN 521/4885

“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.