Ergocalciferol

Ergocalciferol

SCHEMBL222899

C=C1CCC(O)CC1=CC=C1CCCC2(C)C1CCC2C(C)C=CC(C)C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

VDR

The experimentally established mechanism targets of Ergocalciferol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VDR known ✓ P11473 4/20 0.77
▸ ALDH1A1 P00352 3/20 1.00
▸ ALOX15 P16050 3/20 1.00
▸ CYP3A4 P08684 3/20 1.00
▸ LMNA P02545 2/20 1.00
▸ HSPD1 P10809 2/20 1.00
▸ PTGS1 P23219 2/20 1.00
▸ HSPE1 P61604 2/20 1.00
▸ ADRA1A P35348 2/20 1.00
▸ AR P10275 1/20 1.00
▸ TSHR P16473 1/20 1.00
▸ CYP2C9 P11712 1/20 1.00
▸ CYP2C19 P33261 1/20 1.00
▸ USP2 O75604 1/20 1.00
▸ ABCB11 O95342 1/20 1.00
▸ ESR1 P03372 1/20 1.00
▸ TST Q16762 1/20 1.00
▸ MEN1 O00255 4/20 0.71
▸ KMT2A Q03164 4/20 0.71
▸ PGR P06401 3/20 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
Ergocalciferol SCHEMBL13693869 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL13526523 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL12464764 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL24855744 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL14404820 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL24565106 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL19386228 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL3422 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL20510995 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1
Ergocalciferol SCHEMBL2390787 1.00 ALDH1A1 (1.00) ALDH1A1ALOX15CYP3A4LMNAHSPD1

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 883 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260063626-A1 COMPARTMENTAL ANALYSIS OF EXTRACORPOREAL LIVER PERFUSION SYSTEMS HEPQUANT LLC (US) 2026-03-05 — — US claimed
US-20230381195-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF TRAUMATIC BRAIN INJURY (TBI) AND RELATED DISORDERS MEHRA AKHIL (US) 2023-11-30 — — US claimed
EP-3837359-A1 METHODS AND COMPOSITIONS FOR TREATING MITOCHONDRIAL DISEASE OR DISORDERS AND HETEROPLASMY Imel Biotherapeutics, Inc. (US) 2021-06-23 — — EP claimed
US-20210106592-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF TRAUMATIC BRAIN INJURY (TBI) AND RELATED DISORDERS MEHRA AKHIL (US) 2021-04-15 — — US claimed
US-20200054682-A1 METHODS AND COMPOSITIONS FOR TREATING MITOCHONDRIAL DISEASE OR DISORDERS AND HETEROPLASMY IMEL BIOTHERAPEUTICS INC (US) 2020-02-20 — — US claimed
WO-2020036973-A1 METHODS AND COMPOSITIONS FOR TREATING MITOCHONDRIAL DISEASE OR DISORDERS AND HETEROPLASMY Imel Biotherapeutics, Inc. (US) 2020-02-20 — — WO claimed
US-20180000685-A1 NEUROLOGIC THERAPY DEVICES, SYSTEMS, AND METHODS NeuroRhythmics, Inc. 2018-01-04 — — US claimed
WO-2018005757-A1 NEUROLOGIC THERAPY DEVICES, SYSTEMS, AND METHODS NeuroRhythmics, Inc. (US) 2018-01-04 — — WO claimed
EP-2048852-B1 Service aggregation system and method FIFTHPLAY NV (BE) 2016-01-27 — — EP claimed
WO-2013119326-A1 NEUROPSYCHIATRIC TEST REPORTS GENOMIND, LLC (US) 2013-08-15 — — WO claimed
CN-101090721-A Selective serotonin receptor inverse agonists as therapeutics for disease ACADIA PHARM INC (US) 2007-12-19 — — CN claimed
EP-1814979-A2 TRANSPLANTATION OF HUMAN NEURAL CELLS FOR TREATMENT OF NEURODEGENERATIVE CONDITIONS Neuralstem, Inc. (US) 2007-08-08 — — EP claimed
EP-1750705-A1 SELECTIVE SEROTONIN RECEPTOR INVERSE AGONISTS AS THERAPEUTICS FOR DISEASE Acadia Pharmaceuticals Inc. (US) 2007-02-14 — — EP claimed
WO-2006055685-A2 TRANSPLANTATION OF HUMAN NEURAL CELLS FOR TREATMENT OF NEURODEGENERATIVE CONDITIONS NEURALSTEM, INC. (US) 2006-05-26 — — WO claimed
WO-2005112927-A1 SELECTIVE SEROTONIN RECEPTOR INVERSE AGONISTS AS THERAPEUTICS FOR DISEASE ACADIA PHARMACEUTICALS INC. (US) 2005-12-01 — — WO claimed
US-20050261278-A1 Selective serotonin receptor inverse agonists as therapeutics for disease ACADIA PHARMACEUTICALS INC. 2005-11-24 — — US claimed
US-20040067907-A1 Process for delivery of polynucleotides to the prostate ROCHE MADISON INC. 2004-04-08 — — US claimed
US-6250306-B1 Assessment of ischemic wound healing therapeutics ETHICON, INC. 2001-06-26 — — US claimed
US-5858004-A Head projections on shielded butterfly needle assemblies SHIELDS JACK W (US) 1999-01-12 — — US claimed
US-4649939-A Mid-hind foot stabilizer NIKE, INC. 1987-03-17 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20200054682-A1 METHODS AND COMPOSITIONS FOR TREATING MITOCHONDRIAL DISEASE OR DISORDERS AND HETEROPLASMY MT-CO2, UQCRC2, TFAM VDR 4542/4885ALDH1A1 2611/4885ALOX15 3237/4885
US-20050261278-A1 Selective serotonin receptor inverse agonists as therapeutics for disease HTR7, HTR6, HTR3B VDR 310/4885ALDH1A1 3248/4885ALOX15 1875/4885
US-20260063626-A1 COMPARTMENTAL ANALYSIS OF EXTRACORPOREAL LIVER PERFUSION SYSTEMS SLC10A1, ABCB11, SLC10A2 VDR 1007/4885ALDH1A1 4224/4885ALOX15 1886/4885

“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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