SCHEMBL6716263

SCHEMBL6716263

CCOC(=O)C(Cc1ccc(OCCNC(=O)c2ccc(-c3ccc(OC)cc3)cc2)cc1)Oc1ccc(C(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 1/20 0.52
EPHX2 P34913 1/20 0.48
HCAR2 Q8TDS4 2/20 0.47
HPGD P15428 1/20 0.45
TP53 P04637 2/20 0.43
MAPT P10636 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PPARG P37231 1/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL6716576 0.93 PPARG (0.46) NPC1SMN1; SMN2RAB9AHCAR2HPGD
SCHEMBL6713067 0.93 NPC1 (0.45) NPC1SMN1; SMN2RAB9AALDH1A1EPHX2
SCHEMBL6715150 0.92 HCAR2 (0.48) NPC1SMN1; SMN2RAB9AALDH1A1EPHX2
SCHEMBL6712975 0.91 GCG (0.47) NPC1SMN1; SMN2RAB9AALDH1A1EPHX2
SCHEMBL6715209 0.91 GCG (0.51) NPC1SMN1; SMN2RAB9AALDH1A1EPHX2
SCHEMBL6722193 0.90 NPC1 (0.54) NPC1SMN1; SMN2RAB9AALDH1A1HCAR2
SCHEMBL6715977 0.89 PPARA (0.50) NPC1SMN1; SMN2RAB9AALDH1A1EPHX2
SCHEMBL6713405 0.87 GCG (0.44) NPC1SMN1; SMN2RAB9AHCAR2HPGD
SCHEMBL6713127 0.86 NPC1 (0.52) NPC1SMN1; SMN2RAB9AHPGDMAPT
SCHEMBL6713649 0.85 NPC1 (0.55) NPC1SMN1; SMN2RAB9AEPHX2HPGD

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 NPC1 812/4885SMN1; SMN2 4310/4885RAB9A 3140/4885

“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.