SCHEMBL13701718

SCHEMBL13701718

CC(C)(C)NC(=O)c1ccc(Oc2ccccc2)nc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRN P28799 2/20 0.63
SORT1 Q99523 2/20 0.63
CTSA P10619 2/20 0.54
GABRA5 P31644 1/20 0.54
OPRM1 P35372 6/20 0.51
OPRD1 P41143 6/20 0.51
HPGDS O60760 2/20 0.51
LIPE Q05469 2/20 0.50
HRH3 Q9Y5N1 1/20 0.50
OPRK1 P41145 4/20 0.49
PKM P14618 1/20 0.47
GALR3 O60755 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 1/20 0.46

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
SCHEMBL6120802 0.84 OPRM1 (0.67) GRNSORT1CTSAGABRA5OPRM1
SCHEMBL13485797 0.82 GRN (0.58) GRNSORT1CTSAOPRM1OPRD1
SCHEMBL14226713 0.81 GRN (0.57) GRNSORT1CTSAOPRM1OPRD1
SCHEMBL6927923 0.81 GABRA5 (0.63) GRNSORT1GABRA5
SCHEMBL13701799 0.81 NNMT (0.58) GRNSORT1GABRA5HPGDSRAB9A
SCHEMBL30212494 0.81 GRN (0.57) GRNSORT1CTSAOPRM1OPRD1
SCHEMBL7637674 0.80 NPC1 (0.63) GRNSORT1CTSARAB9A
SCHEMBL29523613 0.80 GRN (0.60) GRNSORT1CTSAGABRA5OPRM1
SCHEMBL29035422 0.80 GRN (0.60) GRNSORT1CTSAGABRA5OPRM1
SCHEMBL3586183 0.80 LMNA (0.60) GRNSORT1CTSAGABRA5OPRM1

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 GRN 4400/4885SORT1 3475/4885CTSA 2226/4885

“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.