SCHEMBL6713340

SCHEMBL6713340

O=C(NCCOc1ccc(CC(Oc2ccccc2)C(=O)O)cc1)c1ccc(-c2ccccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
HPGD P15428 1/20 0.53
PPARG P37231 15/20 0.51
PPARA Q07869 12/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARD Q03181 2/20 0.47
POLB P06746 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47

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
SCHEMBL6713267 0.99 PPARG (0.52) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6716421 0.95 PPARG (0.54) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6716279 0.95 PPARG (0.52) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6715583 0.95 PPARG (0.56) NPC1PPARGPPARA
SCHEMBL6722372 0.95 PPARG (0.52) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6716304 0.93 NPC1 (0.47) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6715242 0.93 PPARG (0.47) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6722401 0.93 PPARG (0.46) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6715252 0.93 PPARG (0.47) NPC1RAB9ASMN1; SMN2HPGDPPARG
SCHEMBL6715250 0.93 PPARG (0.47) NPC1RAB9ASMN1; SMN2HPGDPPARG

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-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US claimed
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 812/4885RAB9A 3140/4885SMN1; SMN2 4310/4885

“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.