SCHEMBL3486465

SCHEMBL3486465

CCN(c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1)S(C)(=O)=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 12/20 0.62
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
SLC2A2 P11168 1/20 0.43
RET P07949 2/20 0.43
CDK2 P24941 2/20 0.43
GSK3B P49841 2/20 0.43
ITK Q08881 2/20 0.43
MERTK Q12866 2/20 0.43
PRKAA1 Q13131 2/20 0.43
ROCK1 Q13464 2/20 0.43
MAP3K6 O95382 2/20 0.42
RXFP1 Q9HBX9 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL3485453 0.80 MAP3K5 (0.68) MAP3K5MEN1LMNAKMT2ARET
SCHEMBL3485929 0.77 MAP3K5 (0.67) MAP3K5MEN1KMT2ACDK2
SCHEMBL3486097 0.77 MAP3K5 (1.00) MAP3K5RETCDK2GSK3BITK
SCHEMBL3486350 0.76 MAP3K5 (0.84) MAP3K5RETCDK2GSK3BITK
SCHEMBL3486275 0.76 MAP3K5 (0.76) MAP3K5RETCDK2GSK3BITK
SCHEMBL3486068 0.76 MAP3K5 (0.65) MAP3K5CDK2ALDH1A1
SCHEMBL3486443 0.75 MAP3K5 (0.79) MAP3K5RETCDK2GSK3BITK
Hydrochloric Acid SCHEMBL3486202 0.74 MAP3K5 (0.77) MAP3K5RETCDK2GSK3BITK
SCHEMBL13862003 0.74 MAP3K5 (0.67) MAP3K5RETCDK2GSK3BITK
SCHEMBL3485910 0.74 MAP3K5 (0.77) MAP3K5RETCDK2GSK3BITK

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
US-20100029619-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMTED (JP) 2010-02-04 US disclosed
US-20100029619-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMTED (JP) 2010-02-04 US disclosed
EP-2058309-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-05-13 EP 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-20100029619-A1 FUSED HETEROCYCLIC COMPOUND IRAK1, IL1R1, IRAK2 MAP3K5 42/4885MEN1 758/4885LMNA 3564/4885

“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.