SCHEMBL4609491

SCHEMBL4609491

CCOc1ccc(N(C(=O)NCCO)c2ccnc(NC(C)COC)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.56
ALDH1A1 P00352 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4609495 1.00 MAPK14 (0.56) MAPK14ALDH1A1TAS1R3TAS1R1RAB9A
SCHEMBL4609374 0.95 MAPK14 (0.55) MAPK14ALDH1A1TAS1R3TAS1R1RAB9A
SCHEMBL4609384 0.95 MAPK14 (0.55) MAPK14ALDH1A1TAS1R3TAS1R1RAB9A
SCHEMBL4608671 0.94 MAPK14 (0.54) MAPK14ALDH1A1RAB9A
SCHEMBL4608667 0.94 MAPK14 (0.54) MAPK14ALDH1A1RAB9A
SCHEMBL4624341 0.94 MAPK14 (0.57) MAPK14ALDH1A1TAS1R3TAS1R1SMN1; SMN2
SCHEMBL4624344 0.94 MAPK14 (0.57) MAPK14ALDH1A1TAS1R3TAS1R1SMN1; SMN2
SCHEMBL4623446 0.94 MAPK14 (0.57) MAPK14ALDH1A1RAB9ASMN1; SMN2
SCHEMBL4623451 0.94 MAPK14 (0.57) MAPK14ALDH1A1RAB9ASMN1; SMN2
SCHEMBL4655970 0.93 MAPK14 (0.58) MAPK14

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 2674/4885ALDH1A1 455/4885TAS1R3 2550/4885

“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.