SCHEMBL4608469

SCHEMBL4608469

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

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.57
HPGD P15428 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL4608464 1.00 MAPK14 (0.57) MAPK14HPGDNPSR1MEN1KMT2A
SCHEMBL4609168 0.93 MAPK14 (0.59) MAPK14MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4608978 0.93 MAPK14 (0.59) MAPK14HPGDSMN1; SMN2
SCHEMBL4609170 0.93 MAPK14 (0.59) MAPK14MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4608972 0.93 MAPK14 (0.59) MAPK14HPGDSMN1; SMN2
SCHEMBL4624341 0.91 MAPK14 (0.57) MAPK14TAS1R3TAS1R1SMN1; SMN2ALDH1A1
SCHEMBL4623451 0.91 MAPK14 (0.57) MAPK14HPGDMEN1KMT2ASMN1; SMN2
SCHEMBL4623446 0.91 MAPK14 (0.57) MAPK14HPGDMEN1KMT2ASMN1; SMN2
SCHEMBL4624344 0.91 MAPK14 (0.57) MAPK14TAS1R3TAS1R1SMN1; SMN2ALDH1A1
SCHEMBL4609491 0.90 MAPK14 (0.56) MAPK14TAS1R3TAS1R1SMN1; SMN2ALDH1A1

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 claimed
EP-1747204-B1 TRI-SUBSTITUTED UREAS AS CYTOKINE INHIBITORS PROCTER & GAMBLE (US) 2008-07-30 EP claimed
US-20050239811-A1 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-10-27 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-20050239811-A1 Tri-substituted ureas as cytokine inhibitors IL1B, IL1A, IL6 MAPK14 2674/4885HPGD 612/4885NPSR1 1426/4885

“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.