SCHEMBL7970252

SCHEMBL7970252

CC(C)NC(=O)c1ccc2c(c1)COC2=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.53
MAPT P10636 3/20 0.52
HSD17B10 Q99714 1/20 0.52
PRF1 P14222 1/20 0.51
ROCK2 O75116 11/20 0.50
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 2/20 0.48
RAB9A P51151 1/20 0.48
ROCK1 Q13464 1/20 0.47
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL7636169 0.84 PRF1 (0.68) NPC1MAPTHSD17B10PRF1ROCK2
SCHEMBL3939499 0.82 NPC1 (0.58) NPC1MAPTHSD17B10PRF1ALDH1A1
SCHEMBL3029409 0.81 MAPT (0.55) NPC1MAPTHSD17B10PRF1ROCK2
SCHEMBL7781294 0.80 MAPT (0.49) NPC1MAPTHSD17B10PRF1ALDH1A1
SCHEMBL7979559 0.80 ROCK2 (0.54) NPC1MAPTHSD17B10PRF1ROCK2
SCHEMBL7207192 0.80 PRF1 (0.54) NPC1MAPTHSD17B10PRF1ROCK2
SCHEMBL1466724 0.79 MAPT (0.58) NPC1MAPTHSD17B10PRF1ALDH1A1
SCHEMBL12634064 0.77 NPC1 (0.50) NPC1MAPTHSD17B10PRF1ROCK2
SCHEMBL1407977 0.77 MAPT (0.56) NPC1MAPTPRF1ALDH1A1KDM4E
SCHEMBL30625936 0.77 MAPT (0.56) NPC1MAPTPRF1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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 (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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 NPC1 708/4885MAPT 1571/4885HSD17B10 19/4885

“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.