SCHEMBL22236164

SCHEMBL22236164

CC(C)(C)OC(=O)NC1C2CN(Cc3ccc(-n4ccc(NC(=O)N5CCNCC5)nc4=O)cc3)CC21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.37
HRH3 Q9Y5N1 1/20 0.34
ROCK2 O75116 3/20 0.34
NAMPT P43490 3/20 0.33
ATM Q13315 1/20 0.32
PARP1 P09874 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
TEAD1 P28347 1/20 0.32
ENPP2 Q13822 2/20 0.32
FAAH O00519 5/20 0.32
MCHR1 Q99705 1/20 0.32
ABL1 P00519 1/20 0.32
RIN1 Q13671 1/20 0.32

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
SCHEMBL22249259 1.00 JAK1 (0.37) JAK1HRH3ROCK2NAMPTATM
SCHEMBL30276540 0.93 JAK1 (0.38) JAK1HRH3ROCK2NAMPTPARP1
SCHEMBL30276597 0.90 ATM (0.32) JAK1HRH3NAMPTATMFAAH
SCHEMBL22235950 0.89 JAK1 (0.37) JAK1HRH3ROCK2TEAD1ENPP2
SCHEMBL30401127 0.89 PARP1 (0.42) JAK1NAMPTATMPARP1PARP2
SCHEMBL22249207 0.89 JAK1 (0.36) JAK1HRH3ROCK2NAMPTATM
SCHEMBL30276467 0.89 JAK1 (0.36) JAK1HRH3ROCK2NAMPTATM
SCHEMBL30276616 0.88 JAK1 (0.36) JAK1HRH3ROCK2ENPP2FAAH
SCHEMBL22236184 0.88 POLB (0.36) ROCK2FAAH
SCHEMBL30276416 0.87 JAK1 (0.38) JAK1HRH3ROCK2NAMPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230072397-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-03-09 US disclosed
EP-3911643-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 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 (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-20230072397-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 JAK1 4558/4885HRH3 2165/4885ROCK2 2850/4885

“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.