SCHEMBL23015481

SCHEMBL23015481

CC(C)(CN1CCN(Cc2ccc(C(F)(F)F)c(-c3nnco3)c2)CC1)OC(=O)c1cc[nH]n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.35
PPARD Q03181 3/20 0.33
PPARA Q07869 2/20 0.33
AR P10275 1/20 0.33
PPARG P37231 1/20 0.32
PHGDH O43175 1/20 0.31
UTS2R Q9UKP6 1/20 0.31
PARP1 P09874 1/20 0.30
PARP6 Q2NL67 1/20 0.30
PARP2 Q9UGN5 1/20 0.30
PARP3 Q9Y6F1 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
WDR5 P61964 1/20 0.30
CHEK1 O14757 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL20567175 0.79 GPR119 (0.46) NOTUM
SCHEMBL30302082 0.77 MGLL (0.46)
SCHEMBL20567150 0.77 MGLL (0.46)
SCHEMBL20571263 0.76 NOTUM (0.43) NOTUMPHGDHKDM4EMEN1KMT2A
SCHEMBL25639745 0.75 IRAK4 (0.36) NOTUM
SCHEMBL20566364 0.74 NOTUM (0.47) NOTUMMEN1KMT2ATDP1CHEK1
SCHEMBL20571739 0.73 ATM (0.39) NOTUMMEN1KMT2AATM
SCHEMBL30302147 0.70 FAAH (0.55)
SCHEMBL20567003 0.70 FAAH (0.55)
SCHEMBL21821098 0.69 FAAH (0.40) PHGDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10927105-B1 Pyrazole MAGL inhibitors LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2021-02-23 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-10927105-B1 Pyrazole MAGL inhibitors MGLL, PNLIP, LPL NOTUM 91/4885PPARD 111/4885PPARA 106/4885

“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.