SCHEMBL888946

SCHEMBL888946

CC(C)/C=C/c1ccc(-c2ccc(C(C)C)nc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.33
NAAA Q02083 1/20 0.32
MAPT P10636 1/20 0.31
ESR1 P03372 1/20 0.31

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
SCHEMBL889328 0.86 TUBB4A (0.33) MAPTESR1
SCHEMBL12810043 0.85 PTGS2 (0.38) MCHR1ESR1
SCHEMBL24299463 0.80 CYP3A4 (0.37) MAPT
SCHEMBL888893 0.80 CHRNA7 (0.36) NAAAMAPTESR1
SCHEMBL12810240 0.79 ALDH1A1 (0.39) NAAA
SCHEMBL5018725 0.74 NPC1 (0.45) MAPT
SCHEMBL890116 0.74 NPC1 (0.39) MAPT
SCHEMBL889387 0.74 EGLN1 (0.44) MAPTESR1
SCHEMBL30475177 0.74 GRM5 (0.36)
SCHEMBL28985166 0.74 GRM5 (0.36)

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-8759332-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-06-24 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 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-20110064697-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 MCHR1 4638/4885NAAA 2740/4885MAPT 4286/4885

“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.