SCHEMBL10215308

SCHEMBL10215308

O=C(O)c1cc(O)c2cc(-c3ccoc3)cc(C(F)(F)F)c2n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 4/20 0.47
▸ EPRS1 P07814 1/20 0.36
▸ IGFBP3 P17936 2/20 0.34
▸ KMO O15229 2/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ NPBWR1 P48145 1/20 0.33
▸ P2RY14 Q15391 2/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ ASPH Q12797 1/20 0.32
▸ LDHA P00338 1/20 0.32

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
SCHEMBL10215355 0.84 LDHA (0.45) EPRS1IGFBP3KMOP2RY14SLC6A2
SCHEMBL10215309 0.79 RAB9A (0.43) —
SCHEMBL10215332 0.79 ALDH1A1 (0.43) ERN1
SCHEMBL10215325 0.78 SCD (0.40) ERN1
SCHEMBL10215333 0.77 SCD5 (0.37) ERN1
SCHEMBL10215305 0.77 EPRS1 (0.36) ERN1EPRS1IGFBP3KMONPBWR1
SCHEMBL10215334 0.75 SCD5 (0.47) —
SCHEMBL10215322 0.75 EPRS1 (0.53) EPRS1IGFBP3KMOP2RY14SLC6A2
SCHEMBL3699862 0.73 ERN1 (0.45) ERN1KMOCNR2NPBWR1
SCHEMBL10215608 0.71 RBP4 (0.36) EPRS1IGFBP3P2RY14ASPH

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-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2012-03-01 — — US disclosed
US-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2012-03-01 — — US disclosed
WO-2011156610-A2 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2011-12-15 — — 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-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, FABP1, EIF2AK2 ERN1 163/4885EPRS1 2425/4885IGFBP3 586/4885

“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.

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