SCHEMBL25558707

SCHEMBL25558707

Cc1cc(-n2ccc(NC(=O)N3CCN(C(=O)CCO)CC3)nc2=O)ccc1CN1CCC(N)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TRPV1 Q8NER1 1/20 0.34
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
FAAH O00519 7/20 0.33
EPHX2 P34913 1/20 0.32
ATM Q13315 1/20 0.31
GRIN2B Q13224 1/20 0.31
DPP4 P27487 1/20 0.30
DRD4 P21917 1/20 0.30
PHGDH O43175 1/20 0.30

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
SCHEMBL22233136 0.89 GSK3B (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
Hydrochloric Acid SCHEMBL25205737 0.88 GSK3B (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL22254953 0.88 GSK3B (0.36) TRPV1GSK3BDYRK1AFAAHATM
SCHEMBL22255230 0.88 TRPV1 (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL25547020 0.88 TRPV1 (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL22233796 0.87 GSK3B (0.35) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL22255232 0.87 GSK3B (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL25531588 0.87 GSK3B (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A
SCHEMBL25556936 0.87 ROCK2 (0.37) FAAH
Hydrochloric Acid SCHEMBL22233632 0.87 GSK3B (0.34) MEN1KMT2ATRPV1GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 MEN1 4216/4885KMT2A 4067/4885TRPV1 848/4885

“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.