SCHEMBL4836091

SCHEMBL4836091

COC[C@H](C)Nc1nccc(N(C(=O)NCc2ccncc2)c2ccc(OC)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.56
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CDK2 P24941 1/20 0.39
GSK3B P49841 1/20 0.39
ALDH1A1 P00352 2/20 0.39
NAMPT P43490 2/20 0.39
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL4836078 1.00 MAPK14 (0.56) MAPK14MEN1KMT2ACDK2GSK3B
SCHEMBL4836694 0.91 MAPK14 (0.57) MAPK14MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4836698 0.91 MAPK14 (0.57) MAPK14MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4607994 0.88 MAPK14 (0.60) MAPK14GSK3B
SCHEMBL4608337 0.88 MAPK14 (0.60) MAPK14GSK3B
SCHEMBL4832071 0.87 MAPK14 (0.57) MAPK14MEN1KMT2A
SCHEMBL4832061 0.87 MAPK14 (0.57) MAPK14MEN1KMT2A
SCHEMBL4608972 0.87 MAPK14 (0.59) MAPK14RAB9ASMN1; SMN2
SCHEMBL4609947 0.87 MAPK14 (0.59) MAPK14ALDH1A1RAB9A
SCHEMBL4609953 0.87 MAPK14 (0.59) MAPK14ALDH1A1RAB9A

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-7402589-B2 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-07-22 US claimed
US-20050245555-A1 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-11-03 US claimed

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-20050245555-A1 Tri-substituted ureas as cytokine inhibitors IL1B, IL1A, IL6 MAPK14 2674/4885MEN1 3574/4885KMT2A 3914/4885

“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.