SCHEMBL3975417

SCHEMBL3975417

CC(C)(C)OC(=O)NCC1CCC[N]1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
GFER P55789 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
ACACB O00763 5/20 0.37
ACACA Q13085 3/20 0.37
BTK Q06187 1/20 0.37
DRD2 P14416 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 2/20 0.36
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL4075907 0.89 EPHX1 (0.44) EPHX1GFERTDP1ACACBACACA
SCHEMBL666257 0.76 FUCA1 (0.35) EPHX1NPSR1
SCHEMBL718205 0.76 FUCA1 (0.35) EPHX1NPSR1
SCHEMBL3945996 0.76 EPHX1 (0.43) EPHX1GFERACACBACACADRD2
SCHEMBL6614441 0.75 EPHX1 (0.54) EPHX1GFERTDP1ACACBACACA
SCHEMBL228180 0.75 EPHX1 (0.50) EPHX1TDP1ACACBACACABTK
SCHEMBL10209101 0.75 EPHX1 (0.54) EPHX1ACACBACACADRD2KMT2A
SCHEMBL4377073 0.74 KMT2A (0.56) EPHX1TDP1ACACBACACADRD2
SCHEMBL3816616 0.74 KMT2A (0.56) EPHX1TDP1ACACBACACADRD2
SCHEMBL28987783 0.74 EPHX1 (0.49) EPHX1GFERTDP1ACACBACACA

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-20090264411-A1 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2009-10-22 US disclosed
EP-2054417-A2 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB Pharma S.A. (BE) 2009-05-06 EP disclosed
WO-2008020206-A2 FUSED THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2008-02-21 WO 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 EPHX1 884/4885GFER 3246/4885TDP1 1018/4885

“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.