SCHEMBL13701702

SCHEMBL13701702

CC(C)(C)NC(=O)c1cccc(OCCc2ccncc2)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
ALDH1A1 P00352 1/20 0.53
HTT P42858 1/20 0.52
SLC2A1 P11166 4/20 0.49
GPR132 Q9UNW8 2/20 0.49
POLB P06746 1/20 0.48
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
SLC2A4 P14672 1/20 0.47
SLC2A8 Q9NY64 1/20 0.47
KMT2A Q03164 1/20 0.46
SMPD1 P17405 3/20 0.45

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
SCHEMBL13701726 0.89 LMNA (0.58) LMNAALDH1A1HTTGPR132KMT2A
SCHEMBL13702401 0.86 LMNA (0.55) LMNAHTTSLC2A1GPR132POLB
SCHEMBL13702128 0.84 MAOB (0.57) LMNAHTTSLC2A1GPR132POLB
SCHEMBL13701700 0.82 LMNA (0.54) LMNAALDH1A1HTTGPR132TSHR
SCHEMBL13701720 0.81 LMNA (0.67) LMNAALDH1A1TSHRMAPK1KMT2A
SCHEMBL13701712 0.80 LMNA (0.65) LMNAALDH1A1MAPK1KMT2ASMPD1
SCHEMBL12133228 0.78 LMNA (0.82) LMNAALDH1A1HTTPOLBMAPK1
SCHEMBL13701749 0.76 RAB9A (0.59) LMNAALDH1A1HTTTSHRMAPK1
SCHEMBL13701690 0.76 SMPD1 (0.71) LMNAALDH1A1GPR132KMT2ASMPD1
SCHEMBL13097043 0.75 LTA4H (0.53) SLC2A1SLC2A4SLC2A8

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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors EPHX1, EPHX2, EPX LMNA 1843/4885ALDH1A1 376/4885HTT 3678/4885

“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.