Ercalcitriol

Ercalcitriol

SCHEMBL23142603

C=C1C(=CC=C2CCCC3(C)C2CCC3C(C)C=CC(C)C(C)(C)O)CC(O)CC1O

nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 12/20 0.80
▸ ADORA3 P0DMS8 3/20 0.78
▸ SLC6A2 P23975 3/20 0.78
▸ NR1I2 O75469 2/20 0.78
▸ PGR P06401 2/20 0.78
▸ SLC6A4 P31645 2/20 0.78
▸ ADRA1A P35348 2/20 0.78
▸ PTGS2 P35354 2/20 0.78
▸ HTR1A P08908 1/20 0.78
▸ MAPT P10636 2/20 0.71
▸ AGTR1 P30556 2/20 0.71
▸ ABCB11 O95342 1/20 0.71
▸ GC P02774 1/20 0.71
▸ RXRA P19793 1/20 0.71
▸ CHRM3 P20309 1/20 0.71
▸ CNR1 P21554 1/20 0.71
▸ HTR2C P28335 1/20 0.71
▸ MAPK1 P28482 1/20 0.71
▸ OPRD1 P41143 1/20 0.71
▸ OPRK1 P41145 1/20 0.71

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
Ercalcitriol SCHEMBL17274136 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL17274137 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL4393978 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL9050396 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL12922723 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL264876 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL4393975 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL301082 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL21433255 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL8776000 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR

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-20240293551-A1 USE OF ST-TYPE LIPID COMPOUNDS IN PREPARATION OF NUCLEIC ACID DELIVERY REAGENT AND RELATED PRODUCT BEIJING BAISHIHEKANG PHARMACEUTICAL TECHNOLOGY (BSJPHARMA) CO., LTD (CN) 2024-09-05 — — US disclosed
EP-4378483-A1 USE OF ST-TYPE LIPID COMPOUNDS IN PREPARATION OF NUCLEIC ACID DELIVERY REAGENT AND RELATED PRODUCT Institute of Basic Medical Sciences, Chinese Academy of Medical Sciences (CN) 2024-06-05 — — EP disclosed
CN-115078578-A Serum vitamin D related metabolite detection method based on liquid chromatography-mass spectrometry 广州市妇女儿童医疗中心 2022-09-20 — — CN disclosed
EP-4037690-A1 COMBINED THERAPY COMPRISING AN INHIBITOR OF INTERLEUKIN-17 ACTIVITY AND A VITAMIN D RECEPTOR AGONIST Servei de Salut de Les Illes Balears - Ibsalut (ES) 2022-08-10 — — EP disclosed
WO-2021063945-A1 COMBINED THERAPY COMPRISING AN INHIBITOR OF INTERLEUKIN-17 ACTIVITY AND A VITAMIN D RECEPTOR AGONIST SERVEI DE SALUT DE LES ILLES BALEARS – IBSALUT (ES) 2021-04-08 — — WO disclosed
EP-3797779-A1 COMBINED THERAPY COMPRISING AN INHIBITOR OF INTERLEUKIN-17 ACTIVITY AND A VITAMIN D RECEPTOR AGONIST Servei de Salut de Les Illes Balears - Ibsalut (ES) 2021-03-31 — — EP disclosed
CN-107382804-A A kind of 1 α for preparing high-purity, the method for 25 dihydroxyvitamin Ds 2 南京海融医药科技股份有限公司 2017-11-24 — — CN 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-20240293551-A1 USE OF ST-TYPE LIPID COMPOUNDS IN PREPARATION OF NUCLEIC ACID DELIVERY REAGENT AND RELATED PRODUCT POLRMT, LIPC, POLM VDR 1832/4885ADORA3 1585/4885SLC6A2 709/4885

“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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