SCHEMBL6722563

SCHEMBL6722563

O=C(O)c1ccccc1-c1ccc(O)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.49
CYP2C9 P11712 5/20 0.49
CYP2C8 P10632 3/20 0.49
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 2/20 0.45
LDHA P00338 2/20 0.45
ALDH1A1 P00352 3/20 0.43
ALOX15 P16050 1/20 0.43
HNF4A P41235 1/20 0.43
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
HMGB1 P09429 1/20 0.42
HPGD P15428 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL8841489 0.81 RAB9A (0.54) RAB9ASMN1; SMN2NPC1LDHAALDH1A1
SCHEMBL6716440 0.81 SLC6A3 (0.51) ALDH1A1KDM4ECA12CA1CA2
SCHEMBL8842317 0.80 RAB9A (0.52) RAB9ASMN1; SMN2NPC1LDHAALDH1A1
SCHEMBL3108743 0.79 ALDH1A1 (0.46) CYP2C9RAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL6713244 0.78 BRS3 (0.49) HCAR2RAB9ASMN1; SMN2NPC1LDHA
SCHEMBL31676875 0.78 RAB9A (0.46) RAB9ASMN1; SMN2NPC1LDHAALDH1A1
SCHEMBL6715032 0.78 RAB9A (0.46) RAB9ASMN1; SMN2NPC1LDHAALDH1A1
SCHEMBL6713020 0.78 MYC (0.45) RAB9ASMN1; SMN2NPC1LDHAALDH1A1
SCHEMBL1173966 0.77 KDM4E (0.52) RAB9ASMN1; SMN2NPC1ALDH1A1ALOX15
SCHEMBL30620596 0.77 KDM4E (0.52) RAB9ASMN1; SMN2NPC1ALDH1A1ALOX15

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 HCAR2 429/4885CYP2C9 1036/4885CYP2C8 760/4885

“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.