SCHEMBL6644201

SCHEMBL6644201

Cc1ccc(C(=O)Nc2ccnc(CCN(C(=O)OC(C)(C)C)c3ccccc3)c2)c(N(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
BACE1 P56817 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GRM4 Q14833 1/20 0.35
SORT1 Q99523 3/20 0.35
CYP3A4 P08684 1/20 0.34
OPRL1 P41146 2/20 0.34
AURKA O14965 1/20 0.33
RPS6KB1 P23443 1/20 0.33
LRRK2 Q5S007 1/20 0.33

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
SCHEMBL6645223 0.89 F2 (0.39) F2NPC1RAB9ABACE1GRM4
SCHEMBL6648457 0.89 F2 (0.40) F2BACE1TRPV4MEN1KMT2A
SCHEMBL6644199 0.88 CYP3A4 (0.38) F2NPC1RAB9ACYP3A4
SCHEMBL6645210 0.87 F2 (0.37) F2NPC1RAB9ABACE1TRPV4
SCHEMBL6646586 0.84 SCN10A (0.47) MEN1KMT2A
SCHEMBL6644728 0.83 SCN10A (0.40) F2
SCHEMBL6796112 0.83 MEN1 (0.41) F2BACE1TRPV4MEN1KMT2A
SCHEMBL6645327 0.81 ALDH1A1 (0.43) F2NPC1BACE1MEN1KMT2A
SCHEMBL6645935 0.81 KMT2A (0.42) NPC1RAB9AKMT2ASORT1
SCHEMBL6645763 0.80 NPC1 (0.33) F2NPC1RAB9ASORT1

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-20040133008-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 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-20040133008-A1 Amide compounds APOB, APOL1, LDLR F2 1415/4885NPC1 34/4885RAB9A 3028/4885

“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.