SCHEMBL20515292

SCHEMBL20515292

COc1cccc(OC)c1N(NC(=O)c1cccs1)C(N)=S

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.52
▸ HSP90AA1 P07900 1/20 0.52
▸ AGTR1 P30556 1/20 0.52
▸ APLNR P35414 1/20 0.51
▸ MAPT P10636 8/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ ELANE P08246 1/20 0.49
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ GAA P10253 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.45

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
SCHEMBL20515258 0.80 RAB9A (0.47) HPGDMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20515251 0.75 HPGD (0.50) HPGDMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20515253 0.75 PTK2 (0.41) HPGDHSP90AA1AGTR1MAPTKMT2A
SCHEMBL20515254 0.75 MAPT (0.54) HPGDMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20515268 0.74 GAA (0.53) HPGDMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20515252 0.73 POLB (0.43) HPGDMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL20513984 0.72 ALDH1A1 (0.66) HSP90AA1AGTR1APLNRMAPTKMT2A
SCHEMBL20515283 0.72 MAPT (0.43) HPGDMAPTALDH1A1
SCHEMBL20515262 0.72 KMT2A (0.50) HPGDKMT2AMEN1SMN1; SMN2CYP2C19
SCHEMBL17295044 0.68 APLNR (1.00) HPGDAPLNRMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12071413-B2 Azole derivatives as apelin receptor agonist Sanford Burnham Prebys Medical Discovery Institute (US) 2024-08-27 — — US disclosed
EP-3380970-B1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST SANFORD BURNHAM PREBYS MEDICAL DISCOVERY INST (US) 2023-01-04 — — EP disclosed
US-20220144784-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-05-12 — — US disclosed
US-11155525-B2 Azole derivatives as apelin receptor agonist Sanford Burnham Prebys Medical Discovery Institute (US) 2021-10-26 — — US disclosed
US-20200347022-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-11-05 — — US disclosed
US-10626096-B2 Azole derivatives as apelin receptor agonist Sanford Burnham Prebys Medical Discovery Institute (US) 2020-04-21 — — US disclosed
US-20180282289-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-10-04 — — US 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 (6 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-12071413-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 HPGD 4292/4885HSP90AA1 4883/4885AGTR1 2/4885
US-11155525-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 HPGD 4292/4885HSP90AA1 4883/4885AGTR1 2/4885
US-20200347022-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4302/4885HSP90AA1 4884/4885AGTR1 2/4885
US-20220144784-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4319/4885HSP90AA1 4883/4885AGTR1 2/4885
US-20180282289-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4280/4885HSP90AA1 4883/4885AGTR1 2/4885
US-10626096-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 HPGD 4244/4885HSP90AA1 4883/4885AGTR1 2/4885

“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.

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