SCHEMBL16707356

SCHEMBL16707356

Cc1noc(C)c1C(=O)O/N=C(\N)c1cccc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.52
RXFP1 Q9HBX9 1/20 0.52
KMT2A Q03164 3/20 0.51
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 2/20 0.47
NPC1 O15118 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.44

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
SCHEMBL16707351 0.85 ADORA3 (0.69) ADORA3KMT2AMAPTLMNANPC1
SCHEMBL16697304 0.74 ADORA3 (0.53) ADORA3MAPTALDH1A1NPC1NPSR1
SCHEMBL3882170 0.72 RXFP1 (0.52) RXFP1KMT2AMAPTALDH1A1LMNA
SCHEMBL16707354 0.68 MAPT (0.49) ADORA3MAPTNPC1NPSR1RAB9A
SCHEMBL16707357 0.68 MAPT (0.64) ADORA3KMT2AMAPTNPC1NPSR1
SCHEMBL16697602 0.68 ADORA3 (0.82) ADORA3MAPTALDH1A1LMNAHPGD
SCHEMBL13734246 0.67 GPBAR1 (0.61) KMT2AMAPTALDH1A1LMNANPC1
SCHEMBL16697810 0.67 NPC1 (0.55) ADORA3MAPTALDH1A1NPC1NPSR1
SCHEMBL642821 0.65 CES2 (0.56) KMT2AMAPTALDH1A1
SCHEMBL31011141 0.65 CES2 (0.56) KMT2AMAPTALDH1A1

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 2 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

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 2615/4885RXFP1 3443/4885KMT2A 1919/4885

“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.