SCHEMBL16701196

SCHEMBL16701196

Cc1cc(C)c(C(=O)O/N=C(\N)c2ccc3c(c2)OCO3)c(C)c1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.72
NPC1 O15118 11/20 0.72
MAPT P10636 10/20 0.72
SMN1; SMN2 Q16637 6/20 0.72
LMNA P02545 2/20 0.72
ALDH1A1 P00352 2/20 0.72
PKM P14618 3/20 0.69
KMT2A Q03164 3/20 0.69
POLB P06746 2/20 0.61
MEN1 O00255 1/20 0.55
PTGS2 P35354 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 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
SCHEMBL16701199 1.00 RAB9A (0.72) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16698155 0.81 RAB9A (0.61) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16698157 0.81 RAB9A (0.61) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL14027380 0.80 RAB9A (0.76) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16701197 0.78 NPC1 (0.49) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16697642 0.78 RAB9A (0.62) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16697639 0.78 RAB9A (0.62) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL14027376 0.77 RAB9A (0.77) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16697855 0.73 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2LMNA
SCHEMBL16697859 0.73 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2LMNA

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 RAB9A 465/4885NPC1 922/4885MAPT 4607/4885

“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.