SCHEMBL4608370

SCHEMBL4608370

CCOc1ccc(N(C(=O)NCCCCO)c2ccnc(N[C@@H](C)C(C)(C)O)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.55
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4608364 1.00 MAPK14 (0.55) MAPK14NPC1RAB9APOLBALDH1A1
SCHEMBL4610025 0.97 MAPK14 (0.56) MAPK14NPC1RAB9AALDH1A1GAA
SCHEMBL4610019 0.97 MAPK14 (0.56) MAPK14NPC1RAB9AALDH1A1GAA
SCHEMBL4609076 0.94 MAPK14 (0.58) MAPK14RAB9APOLBSMN1; SMN2
SCHEMBL4609073 0.94 MAPK14 (0.58) MAPK14RAB9APOLBSMN1; SMN2
SCHEMBL4609512 0.92 MAPK14 (0.65) MAPK14NPC1RAB9A
SCHEMBL4609510 0.92 MAPK14 (0.65) MAPK14NPC1RAB9A
SCHEMBL4610627 0.92 MAPK14 (0.56) MAPK14NPC1RAB9APOLBALDH1A1
SCHEMBL4610632 0.92 MAPK14 (0.56) MAPK14NPC1RAB9APOLBALDH1A1
SCHEMBL4609325 0.91 MAPK14 (0.57) MAPK14NPC1RAB9AALDH1A1SMN1; SMN2

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-7449474-B2 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-11-11 US disclosed
EP-1747204-B1 TRI-SUBSTITUTED UREAS AS CYTOKINE INHIBITORS PROCTER & GAMBLE (US) 2008-07-30 EP disclosed
US-20050239811-A1 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-10-27 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-20050239811-A1 Tri-substituted ureas as cytokine inhibitors IL1B, IL1A, IL6 MAPK14 2674/4885NPC1 3402/4885RAB9A 2976/4885

“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.