SCHEMBL6717835

SCHEMBL6717835

CCOC(=O)C(Cc1ccc(OCCNC(=O)c2ccc(-c3ccccn3)cc2)cc1)Oc1ccc(C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
MAPK14 Q16539 2/20 0.42
SMO Q99835 1/20 0.42
NPC1 O15118 6/20 0.41
RAB9A P51151 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 2/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
MMP3 P08254 1/20 0.40
HSD17B10 Q99714 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TGFBR1 P36897 1/20 0.39
HPGDS O60760 1/20 0.39

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
SCHEMBL6712846 0.94 PPARG (0.47) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6717755 0.93 NPC1 (0.48) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6715973 0.92 NPC1 (0.51) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6714895 0.91 NPC1 (0.49) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6716164 0.90 PPARG (0.45) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6718245 0.90 NPC1 (0.50) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6722401 0.90 PPARG (0.46) PPARGNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6716228 0.90 RAB9A (0.52) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6713405 0.90 GCG (0.44) PPARGMAPK14SMONPC1RAB9A
SCHEMBL6715781 0.89 TRPV1 (0.46) PPARGMAPK14SMONPC1RAB9A

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-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 PPARG 23/4885MAPK14 2722/4885SMO 2663/4885

“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.