SCHEMBL7994910

SCHEMBL7994910

CC(C)(Oc1cccc(F)c1)C(=O)NN

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
SSTR4 P31391 1/20 0.44
ADORA2A P29274 2/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
USP2 O75604 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PPARA Q07869 2/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
MAOB P27338 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
PPARD Q03181 1/20 0.38

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
SCHEMBL7974279 0.84 CNR1 (0.43) CNR1CNR2USP2PPARAALDH1A1
SCHEMBL7998547 0.83 CYP3A4 (0.45) CNR1CNR2KDM4EPPARAMAOB
SCHEMBL12670847 0.83 LMNA (0.47) ADORA2ANPC1RAB9AKDM4EPPARA
SCHEMBL7991799 0.82 OGG1 (0.55) CNR1CNR2KMT2AKDM4EPPARA
SCHEMBL3373353 0.81 PPARA (0.54) CNR1CNR2KMT2AKDM4EPPARA
SCHEMBL1417538 0.81 ALDH1A1 (0.49) CNR1ADORA2AKMT2APPARAALDH1A1
SCHEMBL7980965 0.80 ALDH1A1 (0.43) CNR1CNR2ADORA2AKMT2APPARA
SCHEMBL15545847 0.80 CNR1 (0.46) CNR1CNR2SSTR4MRGPRX4NPC1
Hydrochloric Acid SCHEMBL1417420 0.79 ADORA2A (0.42) CNR1CNR2ADORA2AKMT2APPARA
SCHEMBL12670838 0.78 PDK1 (0.44) CNR1CNR2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 CNR1 1917/4885CNR2 2787/4885SSTR4 893/4885

“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.