SCHEMBL16697370

SCHEMBL16697370

O=C(O)c1c(-c2ccccc2Cl)noc1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.55
▸ HSD17B10 Q99714 1/20 0.51
▸ CYP2C19 P33261 2/20 0.50
▸ GPBAR1 Q8TDU6 6/20 0.49
▸ LMNA P02545 1/20 0.49
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ PLAU P00749 1/20 0.46
▸ ELANE P08246 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 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
SCHEMBL13734244 0.77 HSD17B10 (0.59) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL30395456 0.77 HSD17B10 (0.76) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL459354 0.77 HSD17B10 (0.76) MAPTHSD17B10CYP2C19GPBAR1LMNA
Hydrochloric Acid SCHEMBL11554371 0.76 HSD17B10 (0.74) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL899864 0.74 HSD17B10 (0.52) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL16698299 0.73 GPBAR1 (0.65) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL16697481 0.71 HSD17B10 (0.52) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL29059059 0.71 MAPT (1.00) MAPTHSD17B10CYP2C19LMNAKMT2A
SCHEMBL27910275 0.70 HSD17B10 (0.78) MAPTHSD17B10CYP2C19GPBAR1LMNA
SCHEMBL16698055 0.69 HSD17B10 (0.53) MAPTHSD17B10CYP2C19GPBAR1LMNA

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-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors VIROCURA THERAPEUTICS INC (CA) 2015-05-14 — — 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-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors EIF2AK2, GTF3C4, GTF3C1 MAPT 4607/4885HSD17B10 1479/4885CYP2C19 1782/4885

“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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