SCHEMBL25907965

SCHEMBL25907965

CCOC(=O)Cc1ccc(C(F)(F)F)cc1OCC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MBOAT4 Q96T53 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
MDM2 Q00987 1/20 0.41
CETP P11597 1/20 0.41
RET P07949 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL23241820 0.84 PPARD (0.39) CYP1A2CYP2C9CYP2C19MRGPRX4L3MBTL1
SCHEMBL513210 0.83 IDO1 (0.48) CYP1A2CYP2C9CYP2C19MRGPRX4L3MBTL1
SCHEMBL29852434 0.83 ANO1 (0.45) MRGPRX4L3MBTL1GAAALDH1A1POLB
SCHEMBL23218135 0.83 ANO1 (0.45) MRGPRX4L3MBTL1GAAALDH1A1POLB
SCHEMBL23229180 0.81 TBXAS1 (0.43) CYP1A2CYP2C9CYP2C19ALDH1A1POLB
SCHEMBL24651096 0.81 POLB (0.45) CYP1A2CYP2C9CYP2C19L3MBTL1GAA
SCHEMBL21561992 0.81 NLRP3 (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1ALDH1A1
SCHEMBL29886373 0.81 LIPG (0.46) CYP2C19MRGPRX4ALDH1A1PPARGPPARA
SCHEMBL24651099 0.81 POLB (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1GAA
SCHEMBL21223098 0.79 CYP2C19 (0.51) CYP1A2CYP2C9CYP2C19MBOAT4L3MBTL1

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-11708347-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-07-25 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-11708347-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors C9, C5, C1QBP CYP1A2 170/4885CYP2C9 200/4885CYP2C19 67/4885

“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.