SCHEMBL20514204

SCHEMBL20514204

COc1cccc(OC)c1NC(=S)NNC(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 8/20 0.64
▸ RAB9A P51151 11/20 0.60
▸ NPC1 O15118 9/20 0.60
▸ ALDH1A1 P00352 5/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ MAPT P10636 2/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ POLB P06746 1/20 0.53
▸ HPGD P15428 1/20 0.52

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
SCHEMBL16127142 0.87 EPHX1 (0.62) RAB9ANPC1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL22624859 0.85 RAB9A (0.63) GAARAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL20515255 0.84 GAA (0.73) GAAALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL20514022 0.83 GAA (0.51) GAARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL16119691 0.80 EPHX1 (0.60) RAB9ANPC1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL20513984 0.79 ALDH1A1 (0.66) GAARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL15484253 0.78 HPGD (0.51) GAAALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL20514287 0.78 HPGD (0.49) GAARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL17297997 0.77 GAA (0.83) GAARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL20514063 0.77 POLB (0.64) GAARAB9ANPC1ALDH1A1SMN1; 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 10 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-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-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
EP-3380970-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST Sanford Burnham Prebys Medical Discovery Institute (US) 2018-10-03 — — 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 (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 GAA 4811/4885RAB9A 3035/4885NPC1 1041/4885
US-11155525-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 GAA 4811/4885RAB9A 3035/4885NPC1 1041/4885
US-20200347022-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 GAA 4828/4885RAB9A 2687/4885NPC1 1096/4885
US-20220144784-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 GAA 4811/4885RAB9A 2791/4885NPC1 1039/4885
US-20180282289-A1 NOVEL AZOLE DERIVATIVES AS APELIN RECEPTOR AGONIST APLNR, AGTR1, AGTR2 GAA 4811/4885RAB9A 2793/4885NPC1 1051/4885
US-10626096-B2 Azole derivatives as apelin receptor agonist APLNR, AGTR1, AGTR2 GAA 4813/4885RAB9A 3044/4885NPC1 1047/4885

“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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