SCHEMBL13701697

SCHEMBL13701697

CCOc1ccc(C(=O)NC(C)(C)C)cn1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.62
GABRA5 P31644 1/20 0.54
DGAT1 O75907 1/20 0.47
CXCR1 P25024 1/20 0.46
CXCR2 P25025 1/20 0.46
LMNA P02545 2/20 0.46
HPGDS O60760 1/20 0.45
HTT P42858 1/20 0.43

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
SCHEMBL6932337 0.87 GABRA5 (0.51) MAPTGABRA5LMNAHPGDS
SCHEMBL13701799 0.84 NNMT (0.58) MAPTGABRA5CXCR1CXCR2LMNA
SCHEMBL13701755 0.84 L3MBTL1 (0.65) MAPTGABRA5DGAT1
SCHEMBL1091622 0.83 MAPT (0.68) MAPTGABRA5CXCR1CXCR2
SCHEMBL6927923 0.82 GABRA5 (0.63) GABRA5CXCR1CXCR2
SCHEMBL13702389 0.81 MAPT (0.66) MAPTGABRA5DGAT1CXCR1CXCR2
SCHEMBL13875908 0.80 MAPT (0.68) MAPTDGAT1CXCR1CXCR2
SCHEMBL26153240 0.80 LMNA (0.46) MAPTGABRA5LMNAHPGDSHTT
SCHEMBL13701718 0.78 GRN (0.63) GABRA5LMNAHPGDS
SCHEMBL21394819 0.78 MAPT (0.70) MAPTGABRA5LMNA

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-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-05-18 US disclosed
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 (2 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 MAPT 4084/4885GABRA5 3805/4885DGAT1 1488/4885
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1B, SCN1A, SCN2B MAPT 302/4885GABRA5 383/4885DGAT1 4360/4885

“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.