SCHEMBL2583496

SCHEMBL2583496

CC(C(N)=O)c1cn[nH]c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.45
EPHX1 P07099 1/20 0.41
LRRK2 Q5S007 2/20 0.36
FLT4 P35916 2/20 0.36
KDR P35968 1/20 0.36
KCNH2 Q12809 1/20 0.35
LMNA P02545 1/20 0.34
APEX1 P27695 1/20 0.34
PMP22 Q01453 1/20 0.34
PIK3CA P42336 1/20 0.33
HRH2 P25021 1/20 0.33
APP P05067 1/20 0.33
ACACB O00763 1/20 0.32
ROCK2 O75116 3/20 0.32
ROCK1 Q13464 3/20 0.32
PLK1 P53350 1/20 0.31

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
SCHEMBL509533 0.82 NOS2 (0.42) NOS2KCNH2LMNAAPEX1PMP22
SCHEMBL30954596 0.77 NOS2 (0.41) NOS2EPHX1KCNH2HRH2ACACB
SCHEMBL6344963 0.74
SCHEMBL84454 0.72
SCHEMBL6055220 0.72 MEN1 (0.43) EPHX1HRH2ROCK2ROCK1
SCHEMBL9326757 0.72 MEN1 (0.43) EPHX1HRH2ROCK2ROCK1
SCHEMBL2170749 0.70 NOS2 (0.33) NOS2ROCK1
Hydrochloric Acid SCHEMBL20897673 0.70
SCHEMBL17824705 0.69 KCNH2 (0.39) NOS2KCNH2LMNAAPEX1PMP22
SCHEMBL1484347 0.69 EPHX1 (0.44) EPHX1LRRK2FLT4APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025040546-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-02-27 WO claimed
US-11261171-B1 Isoindolinone inhibitors of the MDM2-P53 interaction having anticancer activity ASTEX THERAPEUTICS LIMITED (GB) 2022-03-01 US claimed
EP-2560969-A1 4 - (5 - ISOXAZOLYL OR 5 - PYRRAZOLYL -1,2,4- OXADIAZOL - 3 - YL) -MANDELIC ACID AMIDES AS SPHINGOSIN- 1 - PHOSPHATE 1 RRECEPTOR AGONISTS Bristol-Myers Squibb Company (US) 2013-02-27 EP claimed
WO-2011133734-A1 4 - (5 - ISOXAZOLYL OR 5 - PYRRAZOLYL -1,2,4- OXADIAZOL - 3 - YL) -MANDELIC ACID AMIDES AS SPHINGOSIN- 1 - PHOSPHATE 1 RRECEPTOR AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-27 WO claimed
EP-4626865-A1 CYCLIC PYRAZOLE DIAMIDE IRE1/XBP1S ACTIVATORS Protego Biopharma, Inc. (US) 2025-10-08 EP disclosed
WO-2025040546-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-02-27 WO disclosed
WO-2024118810-A1 CYCLIC PYRAZOLE DIAMIDE IRE1/XBP1S ACTIVATORS PROTEGO BIOPHARMA, INC. (US) 2024-06-06 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-11261171-B1 Isoindolinone inhibitors of the MDM2-P53 interaction having anticancer activity TP53, MDM2, TP53BP1 NOS2 2731/4885EPHX1 4421/4885LRRK2 230/4885

“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.