SCHEMBL2452369

SCHEMBL2452369

N[C@H](C(=O)O)C(O)c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
NR1I2 O75469 1/20 0.53
PTGS1 P23219 1/20 0.53
ADRA1A P35348 1/20 0.53
BLM P54132 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ACHE P22303 1/20 0.47
GRM8 O00222 1/20 0.46
GRM4 Q14833 1/20 0.46
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 1/20 0.41
NAPRT Q6XQN6 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KIF11 P52732 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2C P18825 1/20 0.36
HIF1A Q16665 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL31000749 1.00 LMNA (0.53) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL2452367 1.00 LMNA (0.53) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL13374285 1.00 LMNA (0.53) LMNANR1I2PTGS1ADRA1ABLM
Hydrochloric Acid SCHEMBL4205224 0.98 LMNA (0.51) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL10501729 0.82 GRM8 (0.39) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL751652 0.81 LMNA (0.58) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL8528068 0.81 LMNA (0.58) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL443815 0.81 LMNA (0.58) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL4086543 0.81 LMNA (0.58) LMNANR1I2PTGS1ADRA1ABLM
SCHEMBL4728748 0.81 LMNA (0.58) LMNANR1I2PTGS1ADRA1ABLM

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851119-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2020-12-01 US disclosed
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2020-05-21 US disclosed
EP-3194359-B1 BORON-CONTAINING DIACYLHYDRAZINE COMPOUNDS INTREXON CORP (US) 2020-04-08 EP disclosed
US-10570158-B2 Boron-containing diacylhydrazine compounds INTREXON CORPORATION (US) 2020-02-25 US disclosed
US-10464951-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2019-11-05 US disclosed
US-20180201628-A1 Boron-Containing Diacylhydrazine Compounds INTREXON CORP (US) 2018-07-19 US disclosed
EP-2970106-B1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2018-05-16 EP disclosed
US-9944659-B2 Boron-containing diacylhydrazine compounds INTREXON CORPORATION (US) 2018-04-17 US disclosed
US-20180079759-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2018-03-22 US disclosed
EP-3194359-A1 BORON-CONTAINING DIACYLHYDRAZINE COMPOUNDS Intrexon Corporation (US) 2017-07-26 EP disclosed
EP-1307214-A1 HIGHLY HOMOGENEOUS MOLECULAR MARKERS FOR ELECTROPHORESIS INVITROGEN CORPORATION (US) 2003-05-07 EP disclosed
EP-1076563-A4 DIPEPTIDE CASPASE INHIBITORS AND THE USE THEREOF CYTOVIA INC (US) 2003-04-23 EP disclosed
CN-1379785-A Caspase inhibitors for the treatment and prevention of chemotherapy and radiotherapy induced cell death CYTOVIA INC (US) 2002-11-13 CN disclosed
US-20020155455-A1 Highly homogeneous molecular markers for electrophoresis INVITROGEN CORPORATION 2002-10-24 US disclosed
EP-1220869-A1 CASPASE INHIBITORS FOR THE TREATMENT AND PREVENTION OF CHEMOTHERAPY AND RADIATION THERAPY INDUCED CELL DEATH Cytovia, Inc. (US) 2002-07-10 EP disclosed
WO-2002013848-A1 HIGHLY HOMOGENEOUS MOLECULAR MARKERS FOR ELECTROPHORESIS INVITROGEN CORPORATION (US) 2002-02-21 WO disclosed
WO-2001027140-A1 CASPASE INHIBITORS FOR THE TREATMENT AND PREVENTION OF CHEMOTHERAPY AND RADIATION THERAPY INDUCED CELL DEATH CYTOVIA, INC. (US) 2001-04-19 WO disclosed
EP-1076563-A1 DIPEPTIDE CASPASE INHIBITORS AND THE USE THEREOF Cytovia, Inc. (US) 2001-02-21 EP disclosed
US-6153591-A PROTECTING NERVOUS SYSTEM FOLLOWING FOCAL ISCHEMIA AND GLOBAL ISCHEMIA; ALZHEIMER'S DISEASE, HUNTINGTON'S DISEASE, PRION DISEASES, PARKINSON'S DISEASE, MULTIPLE SCLEROSIS, AMYOTROPHIC LATERAL SCLEROSIS, ALOPACIA, RHEUMATOID ARTHRITIS CYTOVIA, INC. (US) 2000-11-28 US disclosed
WO-1999047154-A1 DIPEPTIDE CASPASE INHIBITORS AND THE USE THEREOF CYTOVIA, INC. (US) 1999-09-23 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 (7 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-10464951-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR LMNA 4772/4885NR1I2 943/4885PTGS1 4694/4885
US-20180201628-A1 Boron-Containing Diacylhydrazine Compounds BRDT, CD22, BCR LMNA 4750/4885NR1I2 1203/4885PTGS1 4778/4885
US-10851119-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR LMNA 4772/4885NR1I2 943/4885PTGS1 4694/4885
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES CD22, BRDT, BCR LMNA 4772/4885NR1I2 943/4885PTGS1 4694/4885
US-10570158-B2 Boron-containing diacylhydrazine compounds BRDT, CD22, BCR LMNA 4750/4885NR1I2 1203/4885PTGS1 4778/4885
US-20180079759-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR LMNA 4772/4885NR1I2 943/4885PTGS1 4694/4885
US-20020155455-A1 Highly homogeneous molecular markers for electrophoresis CD44, HLA-C, HLA-A LMNA 1264/4885NR1I2 3783/4885PTGS1 1534/4885

“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.