SCHEMBL2636074

SCHEMBL2636074

COC(=O)c1cc(OCC(=O)Nc2cccc(OC)c2)c2c(Cl)cc(Cl)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.55
HPGD P15428 2/20 0.55
MAPT P10636 4/20 0.53
TP53 P04637 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
RAB9A P51151 2/20 0.53
ALDH1A1 P00352 5/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL2635960 0.92 NPC1 (0.57) NPC1HPGDMAPTTP53SMN1; SMN2
SCHEMBL2635555 0.89 MAPT (0.52) NPC1HPGDMAPTSMN1; SMN2RAB9A
SCHEMBL12004284 0.88 MAPT (0.49) NPC1HPGDMAPTTP53SMN1; SMN2
SCHEMBL2635692 0.87 RAB9A (0.44) NPC1HPGDMAPTTP53SMN1; SMN2
SCHEMBL2636019 0.85 MAPT (0.50) NPC1HPGDMAPTSMN1; SMN2RAB9A
SCHEMBL2635311 0.84 ALDH1A1 (0.51) HPGDMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2636505 0.83 NPC1 (0.50) NPC1HPGDMAPTSMN1; SMN2RAB9A
SCHEMBL2635995 0.83 L3MBTL1 (0.44) HPGDMAPTTP53SMN1; SMN2RAB9A
SCHEMBL2635848 0.82 NPC1 (0.52) NPC1MAPTSMN1; SMN2RAB9AALDH1A1
SCHEMBL2635691 0.82 MAPT (0.47) NPC1HPGDMAPTSMN1; SMN2RAB9A

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-20120220577-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO KGAA 2012-08-30 US disclosed
EP-2438037-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP disclosed
WO-2010139481-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 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-20120220577-A1 GLYCINE B ANTAGONISTS GLRB, GRIN2B, GLRA2 NPC1 215/4885HPGD 432/4885MAPT 1202/4885

“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.