SCHEMBL3217049

SCHEMBL3217049

Cc1ccc(-c2ccc(N3CCOCC3)nc2)cc1NC(=O)Nc1sc(C(C)(C)C)cc1C(=O)N1CCNC(=O)C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.41
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
RPS6KB1 P23443 1/20 0.36
KCNH2 Q12809 1/20 0.35
HDAC1 Q13547 1/20 0.35
WNT3A P56704 1/20 0.35

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
SCHEMBL3218599 0.90 MAPK14 (0.45) MAPK14RPS6KB1
SCHEMBL3222886 0.90 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11RPS6KB1
SCHEMBL3197918 0.87 RAF1 (0.43) MAPK14
SCHEMBL3209343 0.86 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11RPS6KB1
SCHEMBL3217289 0.83 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11RPS6KB1
SCHEMBL3215590 0.83 MAPK14 (0.45) MAPK14RPS6KB1
SCHEMBL3208191 0.83 MAPK14 (0.45) MAPK14MAPK13MAPK12MAPK11RPS6KB1
SCHEMBL3221618 0.82 RAF1 (0.42)
SCHEMBL3543209 0.80 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11RPS6KB1
SCHEMBL3204124 0.80 MAPK14 (0.45) MAPK14RPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010019930-A1 UREA DERIVATIVES AS INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 WO disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 US disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 US disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 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-20100041642-A1 UREA INHIBITORS OF MAP KINASES MAP4K2, MAP3K1, MAP3K20 MAPK14 33/4885MAPK13 44/4885MAPK12 46/4885

“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.