SCHEMBL280117

SCHEMBL280117

CNC1CN(C(=O)c2ccc(C)s2)CCC1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
SLC18A3 Q16572 3/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
YEATS4 O95619 1/20 0.35
BCAT2 O15382 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL328077 0.83 ALDH1A1 (0.50) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL280027 0.83 SLC18A3 (0.50) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL279955 0.76 HPGD (0.56) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL14625164 0.74 HPGD (0.57) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL21230300 0.73 HPGD (0.59) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL9921710 0.73 HPGD (0.56) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL280089 0.72 ALDH1A1 (0.51) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL279839 0.71 ALDH1A1 (0.53) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL279692 0.70 HPGD (0.51) ALDH1A1HPGDSLC18A3LMNAGAA
SCHEMBL9918314 0.68 ALDH1A1 (0.50) ALDH1A1HPGDSLC18A3LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 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-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, PTAFR, MPL ALDH1A1 2047/4885HPGD 1895/4885SLC18A3 3749/4885

“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.