SCHEMBL610174

SCHEMBL610174

CC(C)C(N)C(=O)Oc1cc(C=CC(=O)C2CCCC(=Cc3ccc(N(C)C)c(OC(=O)C(N)C(C)C)c3)C2=O)ccc1N(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.43
FGFR1 P11362 9/20 0.39
ACHE P22303 2/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CCR6 P51684 2/20 0.34
NPC1 O15118 1/20 0.33
PTGS2 P35354 2/20 0.32
JUN P05412 1/20 0.31
MME P08473 1/20 0.31
NFKB1 P19838 1/20 0.31
NOD2 Q9HC29 1/20 0.31
HSP90AA1 P07900 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
SCHEMBL610173 1.00 PSMB5 (0.43) PSMB5FGFR1ACHECA1CA2
SCHEMBL626167 0.88 PSMB5 (0.58) PSMB5FGFR1MEN1KMT2ANPC1
SCHEMBL626166 0.88 PSMB5 (0.58) PSMB5FGFR1MEN1KMT2ANPC1
SCHEMBL608515 0.86 FGFR1 (0.34) PSMB5FGFR1ACHECA1CA2
SCHEMBL10061375 0.83 CCR6 (0.40) PSMB5FGFR1ACHEMEN1KMT2A
SCHEMBL610043 0.83 ACHE (0.47) PSMB5ACHEMEN1KMT2ACCR6
SCHEMBL624650 0.83 ACHE (0.47) PSMB5ACHEMEN1KMT2ACCR6
SCHEMBL610088 0.80 ACHE (0.43) ACHECA1CA2MEN1KMT2A
SCHEMBL610089 0.80 ACHE (0.43) ACHECA1CA2MEN1KMT2A
SCHEMBL13341572 0.78 PSMB5 (0.49) PSMB5FGFR1MEN1KMT2ANPC1

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-20120040976-A1 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2012-02-16 US claimed
WO-2010068935-A2 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2010-06-17 WO claimed
US-20120040976-A1 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2012-02-16 US disclosed
WO-2010068935-A2 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2010-06-17 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-20120040976-A1 SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE L1CAM, LY96, GMFG PSMB5 1264/4885FGFR1 4281/4885ACHE 18/4885

“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.