SCHEMBL2143263

SCHEMBL2143263

CC(Cc1cccc(CO)c1)NC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
LMNA P02545 2/20 0.49
TAAR1 Q96RJ0 1/20 0.48
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.43
BCHE P06276 4/20 0.42
ACHE P22303 4/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC7A5 Q01650 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL3922659 0.88 NPC1 (0.53) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL2747349 0.84 NPC1 (0.56) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL2747345 0.84 NPC1 (0.56) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL3930204 0.83 NPC1 (0.51) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL24609344 0.83 NPC1 (0.79) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL2543698 0.83 NPC1 (0.79) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL17330350 0.83 PNMT (0.56) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL951923 0.83 NPC1 (0.55) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL5262284 0.83 SIGMAR1 (0.56) NPC1RAB9ALMNATAAR1KMT2A
SCHEMBL27220740 0.83 SIGMAR1 (0.56) NPC1RAB9ALMNATAAR1KMT2A

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-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 US disclosed
EP-2242759-B1 COMPOUNDS ASTRAZENECA AB (SE) 2012-09-12 EP disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
EP-2242759-A1 COMPOUNDS AstraZeneca AB (SE) 2010-10-27 EP disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 US disclosed
WO-2009098448-A1 COMPOUNDS ASTRAZENECA AB (SE) 2009-08-13 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 (2 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-20120322788-A1 Compouds PKD1, SBDS, ABCB11 NPC1 53/4885RAB9A 2682/4885LMNA 2274/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 NPC1 48/4885RAB9A 1216/4885LMNA 1261/4885

“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.