SCHEMBL5207310

SCHEMBL5207310

Cc1oc(-c2cccc(-c3cccs3)c2)nc1C(C)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.40
NPC1 O15118 5/20 0.39
RAB9A P51151 5/20 0.39
MAPK1 P28482 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 4/20 0.37
NFKB1 P19838 3/20 0.37
NFKB2 Q00653 3/20 0.37
RELA Q04206 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.37
PRMT6 Q96LA8 1/20 0.37
TP53 P04637 3/20 0.37
LMNA P02545 2/20 0.37
HSD17B10 Q99714 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
CA13 Q8N1Q1 1/20 0.37

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
SCHEMBL4915898 0.85 ALDH1A1 (0.43) NPC1RAB9AMAPK1MEN1KMT2A
SCHEMBL5205865 0.80 KDR (0.40) PRMT6CA1CA2CA9
SCHEMBL5123679 0.78 NPC1 (0.48) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL3886258 0.76 KDM4E (0.50) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL5721821 0.73 ALDH1A1 (0.50) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL31539171 0.70 TARBP2 (0.47) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL1334921 0.69 KCNH2 (0.59) ATAD2MEN1KMT2AALDH1A1KDM4E
SCHEMBL7083110 0.68 NPC1 (0.43) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL5207132 0.67 KDM4E (0.45) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4418435 0.66 BRD4 (0.57) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313717-B1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS LILLY CO ELI (US) 2007-10-17 EP disclosed
US-7176224-B2 Oxazolyl-aryloxyacetic acid derivatives and their use as PPAR agonists ELI LILLY AND COMPANY (US) 2007-02-13 US disclosed
US-20040138277-A1 Oxazolyl-aryloxyacetic acid derivatives and their use as ppar agonists ELI LILLY AND COMPANY 2004-07-15 US disclosed
EP-1313717-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
WO-2002016332-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2002-02-28 WO 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-20040138277-A1 Oxazolyl-aryloxyacetic acid derivatives and their use as ppar agonists PPARA, PPARD, PPARG ATAD2 1407/4885NPC1 1199/4885RAB9A 3800/4885

“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.