SCHEMBL23540967

SCHEMBL23540967

CC(C)(C)c1cccc(COc2ccc(C#N)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 10/20 0.59
▸ FFAR1 O14842 2/20 0.47
▸ FFAR4 Q5NUL3 2/20 0.47
▸ NR4A2 P43354 1/20 0.46
▸ RAB9A P51151 1/20 0.45
▸ APP P05067 1/20 0.44
▸ SMPD1 P17405 1/20 0.44
▸ KIF11 P52732 1/20 0.44
▸ AR P10275 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
SCHEMBL13439830 0.87 SMPD1 (0.55) MAOBNR4A2RAB9AAPPSMPD1
SCHEMBL23235861 0.86 MAOB (0.56) MAOBNR4A2RAB9AAPPSMPD1
SCHEMBL13439831 0.86 MAOB (0.52) MAOBFFAR1FFAR4NR4A2
SCHEMBL13439790 0.85 FFAR1 (0.56) MAOBFFAR1FFAR4NR4A2APP
SCHEMBL8756345 0.85 MAOB (0.63) MAOBFFAR1FFAR4NR4A2RAB9A
SCHEMBL28558200 0.84 MAOB (0.76) MAOBFFAR1FFAR4RAB9ASMPD1
SCHEMBL22548672 0.83 MAOB (0.56) MAOBNR4A2RAB9A
SCHEMBL13439789 0.81 APP (0.66) MAOBNR4A2RAB9AAPPKIF11
SCHEMBL23235800 0.81 MRGPRX4 (0.48) AR
SCHEMBL23235773 0.81 MRGPRX4 (0.51) MAOBAR

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-20230105108-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION OF ANTIBIOTICS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2023-04-06 — — US disclosed
EP-4076420-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION OF ANTIBIOTICS Georgia State University Research Foundation, Inc. (US) 2022-10-26 — — EP disclosed
WO-2021127452-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION OF ANTIBIOTICS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-06-24 — — 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-20230105108-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION OF ANTIBIOTICS BPGM, MYD88, PGLS MAOB 2129/4885FFAR1 4278/4885FFAR4 4018/4885

“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.

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