SCHEMBL16697304

SCHEMBL16697304

Cc1noc(C)c1C(=O)O/N=C(\N)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 9/20 0.53
NPC1 O15118 5/20 0.50
RAB9A P51151 4/20 0.50
CDK5 Q00535 1/20 0.50
CDK5R1 Q15078 1/20 0.50
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PKM P14618 1/20 0.47
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL16697307 1.00 ADORA3 (0.53) ADORA3NPC1RAB9ACDK5CDK5R1
SCHEMBL16697305 0.79 ALDH1A1 (0.46) NPSR1ALDH1A1
SCHEMBL16707351 0.79 ADORA3 (0.69) ADORA3NPC1RAB9AMAPTPKM
SCHEMBL16697810 0.78 NPC1 (0.55) ADORA3NPC1RAB9AMAPTNPSR1
SCHEMBL16697814 0.78 NPC1 (0.55) ADORA3NPC1RAB9AMAPTNPSR1
SCHEMBL16707357 0.75 MAPT (0.64) ADORA3NPC1RAB9AMAPTNPSR1
SCHEMBL16707354 0.75 MAPT (0.49) ADORA3NPC1RAB9AMAPTNPSR1
SCHEMBL16697866 0.73 ADORA3 (0.80) ADORA3MAPTALDH1A1
SCHEMBL16697869 0.73 ADORA3 (0.80) ADORA3MAPTALDH1A1
SCHEMBL13089370 0.72 NPC1 (0.81) NPC1RAB9ACDK5CDK5R1MAPT

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-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors VIROCURA THERAPEUTICS INC (CA) 2015-05-14 US disclosed
US-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors VIROCURA THERAPEUTICS INC (CA) 2015-05-14 US disclosed
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 ADORA3 2615/4885NPC1 922/4885RAB9A 465/4885

“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.