SCHEMBL6848423

SCHEMBL6848423

Cc1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 13/20 0.84
NPC1 O15118 12/20 0.84
SMN1; SMN2 Q16637 7/20 0.84
MAPT P10636 5/20 0.84
HPGD P15428 2/20 0.84
NFKB1 P19838 2/20 0.78
NFKB2 Q00653 2/20 0.78
RELA Q04206 2/20 0.78
PKM P14618 2/20 0.78
ALDH1A1 P00352 2/20 0.78
CASP3 P42574 6/20 0.75
SENP7 Q9BQF6 6/20 0.75
KMT2A Q03164 6/20 0.75
MEN1 O00255 5/20 0.75
SENP6 Q9GZR1 2/20 0.74
SENP8 Q96LD8 1/20 0.74
TP53 P04637 1/20 0.74
NPSR1 Q6W5P4 1/20 0.74
TSHR P16473 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.72

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
SCHEMBL6848444 0.91 NPC1 (1.00) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL8768779 0.88 RAB9A (0.82) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL108116 0.88 NPC1 (1.00) RAB9ANPC1SMN1; SMN2MAPTNFKB1
SCHEMBL4727186 0.87 RAB9A (0.81) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL19092878 0.86 NPC1 (0.74) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL2971586 0.85 RAB9A (0.78) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL11238457 0.85 RAB9A (1.00) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL1687778 0.85 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MAPTNFKB1
SCHEMBL10192037 0.85 NPC1 (0.85) RAB9ANPC1SMN1; SMN2MAPTHPGD
SCHEMBL7293767 0.85 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MAPTNFKB1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
WO-2011020849-A1 CYTOHESIN INHIBITORS RHEINISCHE FRIEDRICH-WILHELMS UNIVERSITÄT (DE) 2011-02-24 WO disclosed
EP-2286808-A1 Cytohesin inhibitors Rheinische Friedrich-Wilhelms Universität (DE) 2011-02-23 EP disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 US disclosed
WO-2007084413-A2 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2007-07-26 WO 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 (3 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-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS RAB9A 3975/4885NPC1 297/4885SMN1; SMN2 4525/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS RAB9A 2829/4885NPC1 87/4885SMN1; SMN2 3609/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS RAB9A 2829/4885NPC1 87/4885SMN1; SMN2 3609/4885

“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.