SCHEMBL2635519

SCHEMBL2635519

CCOC(=O)CN(C(=O)CCl)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
PAX8 Q06710 4/20 0.56
JAK2 O60674 2/20 0.56
ALDH1A1 P00352 7/20 0.55
HTT P42858 3/20 0.55
GLA P06280 2/20 0.55
GAA P10253 1/20 0.52
POLB P06746 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
KMT2A Q03164 1/20 0.50
TP53 P04637 3/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
TSHR P16473 2/20 0.46
RNF4 P78317 1/20 0.46
USP2 O75604 1/20 0.44
GPX4 P36969 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL6901552 0.87 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL20169531 0.86 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL6382412 0.86 SMN1; SMN2 (0.59) SMN1; SMN2NPC1RAB9APAX8JAK2
SCHEMBL8858955 0.86 ALDH1A1 (0.57) SMN1; SMN2NPC1RAB9APAX8JAK2
SCHEMBL4434199 0.84 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL5807041 0.84 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL28970973 0.84 RNF4 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1HTT
Hydrochloric Acid SCHEMBL4434198 0.83 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL7174025 0.83 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1GLAGAAPOLB
SCHEMBL9366543 0.83 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1GLAGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115838355-B 1, 4-Disubstituted piperazine-2, 5-dione derivative, preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2024-12-03 CN disclosed
CN-115838355-A 1, 4-disubstituted piperazine-2, 5-diketone derivative, preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2023-03-24 CN disclosed
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
US-4385922-A Method of increasing the yield of legumes utilizing D- or DL-α-O,O-diethlyphosphorodithioylacetylphenylglycine ethyl esters STAUFFER CHEMICAL COMPANY (US) 1983-05-31 US 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 SMN1; SMN2 508/4885NPC1 215/4885RAB9A 2053/4885

“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.