SCHEMBL2285441

SCHEMBL2285441

CCC(C)c1nc(NCC2CCCO2)sc1-c1ccnc(Nc2cc(OC)ccc2OC)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 14/20 0.46
FLT3 P36888 7/20 0.46
MKNK1 Q9BUB5 5/20 0.46
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
RAD52 P43351 1/20 0.44
BLM P54132 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 1/20 0.40
AURKA O14965 1/20 0.39
CDK1 P06493 1/20 0.39
CDK2 P24941 1/20 0.39
CDK7 P50613 1/20 0.39
CDK9 P50750 1/20 0.39
AURKB Q96GD4 1/20 0.39
JAK2 O60674 1/20 0.38
SRC P12931 1/20 0.38
TNK2 Q07912 1/20 0.38
ALK Q9UM73 1/20 0.38

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
SCHEMBL2282854 0.88 PAK4 (0.51) MKNK2FLT3SMN1; SMN2LMNAHTT
SCHEMBL2286341 0.87 AURKA (0.55) MKNK2FLT3POLBSMN1; SMN2AURKA
SCHEMBL2286235 0.87 MKNK2 (0.47) MKNK2FLT3MKNK1POLBSMN1; SMN2
SCHEMBL2289567 0.84 SMN1; SMN2 (0.47) MKNK2FLT3MKNK1POLBSMN1; SMN2
SCHEMBL2284122 0.82 KCNH3 (0.50) POLBSMN1; SMN2LMNABLMHTT
SCHEMBL2284032 0.80 CDK2 (0.46) POLBSMN1; SMN2HTTCDK1CDK2
SCHEMBL2283116 0.80 CDK2 (0.50) POLBSMN1; SMN2LMNAHTTAURKA
SCHEMBL2281570 0.79 MKNK2 (0.55) MKNK2FLT3MKNK1SMN1; SMN2HTT
SCHEMBL2285846 0.79 MKNK2 (0.50) MKNK2FLT3MKNK1SMN1; SMN2HTT
SCHEMBL2286307 0.79 MKNK2 (0.50) MKNK2FLT3MKNK1SMN1; SMN2LMNA

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-20110195968-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-08-11 US disclosed
US-20090030024-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2009-01-29 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 (2 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-20090030024-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, RDX MKNK2 4101/4885FLT3 216/4885MKNK1 4404/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 MKNK2 4185/4885FLT3 211/4885MKNK1 4474/4885

“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.