SCHEMBL18879043

SCHEMBL18879043

CNc1ccnc2ccsc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
AXL P30530 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
ADORA2A P29274 5/20 0.38
ADORA1 P30542 5/20 0.38
PDPK1 O15530 1/20 0.38
PARP1 P09874 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDR P35968 3/20 0.36
UTS2R Q9UKP6 4/20 0.35
ADORA3 P0DMS8 3/20 0.34
ADORA2B P29275 3/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL20265411 0.81 ADORA2A (0.40) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL27174030 0.75 ALK (0.50) HTTKDRPDE4APDE4BPDE4C
SCHEMBL31324910 0.74 AXL (0.44) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL423202 0.74 AXL (0.44) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL22346318 0.73 TRPM5 (0.41) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL31570044 0.71 KDM4C (0.45) MEN1KMT2AUTS2RCYP1A2CYP3A4
SCHEMBL10297716 0.71 KDR (0.46) HTTAXLMKNK1MKNK2PDPK1
SCHEMBL18879036 0.71 CHEK1 (0.41) MEN1KMT2AKDRPIP4K2CCYP1A2
SCHEMBL29365402 0.69 AXL (0.53) HTTAXLMKNK1MKNK2ADORA2A
SCHEMBL21393430 0.69 AXL (0.44) AXLMKNK1MKNK2ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS EFFECTOR THERAPEUTICS, INC. 2017-05-25 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-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS MAP3K9, MAP3K19, MAP3K20 HTT 4376/4885AXL 776/4885MKNK1 78/4885

“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.