SCHEMBL4501703

SCHEMBL4501703

CC1(C)CNC(=O)c2sc(Nc3ccc(I)cc3F)c(C(=O)NCC(=O)O)c2C1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP2K2 P36507 19/20 0.79
MAP2K1 Q02750 19/20 0.79
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4516941 0.92 MAP2K2 (0.82) MAP2K2MAP2K1
SCHEMBL4497546 0.90 MAP2K1 (0.83) MAP2K2MAP2K1
SCHEMBL3973528 0.89 MAP2K2 (1.00) MAP2K2MAP2K1
Hydrochloric Acid SCHEMBL4508860 0.89 MAP2K2 (0.82) MAP2K2MAP2K1
SCHEMBL4511661 0.88 MAP2K2 (0.81) MAP2K2MAP2K1
Hydrochloric Acid SCHEMBL4564102 0.87 MAP2K2 (0.75) MAP2K2MAP2K1
Hydrochloric Acid SCHEMBL4564100 0.87 MAP2K2 (0.75) MAP2K2MAP2K1
SCHEMBL4507213 0.87 MAP2K2 (0.80) MAP2K2MAP2K1
SCHEMBL4505040 0.86 MAP2K1 (1.00) MAP2K2MAP2K1
SCHEMBL4498264 0.86 MAP2K2 (0.88) MAP2K2MAP2K1

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-20090264411-A1 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2009-10-22 US claimed
US-20090264411-A1 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2009-10-22 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-20090264411-A1 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS MAPK15, MOK, MAPK14 MAP2K2 9/4885MAP2K1 12/4885KDM4E 825/4885

“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.