SCHEMBL20515264

SCHEMBL20515264

COc1ccnc(OC)c1N(NC(=O)c1ccc(C)o1)C(N)=S

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.41
▸ HTT P42858 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TSHR P16473 1/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ NR0B1 P51843 1/20 0.37
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ POLB P06746 2/20 0.36
▸ KLK7 P49862 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PKM P14618 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL20515251 0.85 HPGD (0.50) HPGDHTTKDM4EALDH1A1TSHR
SCHEMBL20514117 0.75 HTT (0.43) HPGDHTTKDM4EALDH1A1NPC1
SCHEMBL20515278 0.74 HPGD (0.42) HPGDHTTKDM4EALDH1A1TSHR
SCHEMBL20515268 0.73 GAA (0.53) HPGDHTTKDM4EALDH1A1NPC1
SCHEMBL20515261 0.73 HPGD (0.42) HPGDHTTALDH1A1TSHRNPC1
SCHEMBL20515252 0.70 POLB (0.43) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20515253 0.65 PTK2 (0.41) HPGDHTTKDM4EALDH1A1NPC1
SCHEMBL20515258 0.65 RAB9A (0.47) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL20515292 0.64 HPGD (0.52) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL20515254 0.63 MAPT (0.54) HPGDKDM4EALDH1A1TSHRSMN1; SMN2

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 4292/4885HTT 2973/4885KDM4E 1867/4885
US-11155525-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 HPGD 4292/4885HTT 2973/4885KDM4E 1867/4885
US-20200347022-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4302/4885HTT 2833/4885KDM4E 1779/4885
US-20220144784-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4319/4885HTT 2969/4885KDM4E 1815/4885
US-20180282289-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 HPGD 4280/4885HTT 2826/4885KDM4E 1792/4885
US-10626096-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 HPGD 4244/4885HTT 2871/4885KDM4E 1828/4885

“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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