SCHEMBL2540326

SCHEMBL2540326

COCCCc1ncccc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GCK P35557 2/20 0.41
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PDE10A Q9Y233 1/20 0.40
PLAU P00749 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
ADORA2A P29274 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL8234824 0.95 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL16352667 0.83 RAB9A (0.41) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL12237939 0.82 GCK (0.40) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL9866203 0.81 HRH1 (0.45) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL26464931 0.81 ALOX5 (0.47) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL20099911 0.81 ALDH1A1 (0.42) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL14554001 0.80 PDE10A (0.43) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL2546751 0.79 ALDH1A1 (0.56) SMN1; SMN2NPC1RAB9AGCKHSD17B10
SCHEMBL8554211 0.79 PDE10A (0.42) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL26720549 0.79 PDE10A (0.42) SMN1; SMN2NPC1RAB9ALMNAMEN1

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
EP-2190811-B1 RENIN INHIBITORS MERCK CANADA INC (CA) 2013-08-07 EP disclosed
US-8334308-B2 Renin inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
US-20110263658-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2011-10-27 US disclosed
EP-2190811-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2010-06-02 EP disclosed
WO-2009023964-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2009-02-26 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 (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-20110263658-A1 RENIN INHIBITORS REN, ACE, AGTR1 SMN1; SMN2 4699/4885NPC1 3101/4885RAB9A 204/4885

“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.