SCHEMBL4608972

SCHEMBL4608972

COCC(C)Nc1nccc(N(C(=O)NCC(C)C)c2ccc(OC)cc2)n1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.59
HPGD P15428 3/20 0.41
LCK P06239 3/20 0.37
SRC P12931 3/20 0.37
KDR P35968 3/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 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
SCHEMBL4608978 1.00 MAPK14 (0.59) MAPK14HPGDLCKSRCKDR
SCHEMBL4608469 0.93 MAPK14 (0.57) MAPK14HPGDSMN1; SMN2
SCHEMBL4608464 0.93 MAPK14 (0.57) MAPK14HPGDSMN1; SMN2
SCHEMBL4609117 0.91 MAPK14 (0.62) MAPK14HPGD
SCHEMBL4608337 0.91 MAPK14 (0.60) MAPK14LCKSRCKDR
SCHEMBL4607994 0.91 MAPK14 (0.60) MAPK14LCKSRCKDR
SCHEMBL4609115 0.91 MAPK14 (0.62) MAPK14HPGD
SCHEMBL4609953 0.90 MAPK14 (0.59) MAPK14HPGDLCKSRCKDR
SCHEMBL4609947 0.90 MAPK14 (0.59) MAPK14HPGDLCKSRCKDR
SCHEMBL4610000 0.90 MAPK14 (0.71) 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 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 612/4885LCK 1578/4885

“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.