SCHEMBL2635524

SCHEMBL2635524

COC(=O)c1cc(OCC(=O)c2ccc(OC)cc2)c2c(Cl)cc(Cl)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
POLB P06746 2/20 0.49
BLM P54132 1/20 0.49
MAPT P10636 5/20 0.48
ALDH1A1 P00352 3/20 0.45
LMNA P02545 2/20 0.44
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL2635746 0.90 NPC1 (0.46) NPC1RAB9APOLBMAPTALDH1A1
SCHEMBL2635722 0.83 LMNA (0.38) RAB9ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL2635943 0.83 TDP1 (0.49) SMN1; SMN2POLBMAPTALDH1A1KMT2A
SCHEMBL2636074 0.81 NPC1 (0.55) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL2635914 0.79 ALDH1A1 (0.42) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL2635847 0.79 GAA (0.42) POLBMAPTALDH1A1LMNAGAA
SCHEMBL2635555 0.78 MAPT (0.52) NPC1RAB9ASMN1; SMN2POLBMAPT
SCHEMBL2635997 0.78 ACLY (0.44) SMN1; SMN2POLBMAPTALDH1A1LMNA
SCHEMBL2636251 0.77 RAB9A (0.56) RAB9ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL2636019 0.77 MAPT (0.50) NPC1RAB9ASMN1; SMN2POLBMAPT

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 215/4885RAB9A 2053/4885SMN1; SMN2 508/4885

“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.