25-Hydroxyergocalciferol-

25-Hydroxyergocalciferol-

SCHEMBL1879846

C=C1CC[C@H](O)C/C1=C\C=C1CCC[C@@]2(C)C1CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)(C)O

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.78
ALOX15 P16050 3/20 0.78
CYP3A4 P08684 3/20 0.78
LMNA P02545 2/20 0.78
HSPD1 P10809 2/20 0.78
PTGS1 P23219 2/20 0.78
HSPE1 P61604 2/20 0.78
ADRA1A P35348 2/20 0.78
AR P10275 1/20 0.78
TSHR P16473 1/20 0.78
CYP2C9 P11712 1/20 0.78
CYP2C19 P33261 1/20 0.78
USP2 O75604 1/20 0.78
ABCB11 O95342 1/20 0.78
ESR1 P03372 1/20 0.78
TST Q16762 1/20 0.78
MAPT P10636 3/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
SREBF1 P36956 1/20 0.68
VDR P11473 4/20 0.64

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
25-Hydroxyergocalciferol- SCHEMBL15981129 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL19469428 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL15981131 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL10034123 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL285346 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL9933379 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL465799 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL12464610 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL17274134 1.00 ALDH1A1 (0.78) ALDH1A1ALOX15CYP3A4LMNAHSPD1
25-Hydroxyergocalciferol- SCHEMBL9933381 1.00 ALDH1A1 (0.78) 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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268415-B1 26,27-HOMOLOGATED-20-EPI-2-ALKYL-19-NOR-VITAMIN D COMPOUNDS WISCONSIN ALUMNI RES FOUND (US) 2013-05-29 EP disclosed
US-20110112056-A1 Use of Carbon-2-Modified-Vitamin D Analogs to Induce the Formation of New Bone WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-05-12 US disclosed
US-20100179344-A1 2-Alkylidene-18,19-Dinor-Vitamin D Compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-07-15 US disclosed
US-7713951-B2 2-alkylidene-18,19-dinor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-05-11 US disclosed
US-20090143342-A1 26,27-homologated-20-EPI-2-alkylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION OF MADISON 2009-06-04 US disclosed
US-7468361-B2 2-ethyl and 2-ethylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-12-23 US disclosed
EP-1494680-B1 USE OF CARBON-2-MODIFIED-VITAMIN D ANALOGS TO INDUCE THE FORMATION OF NEW BONE WISCONSIN ALUMNI RES FOUND (US) 2008-09-03 EP disclosed
EP-1286962-B1 2-ETHYL AND 2-ETHYLIDENE-19-NOR-VITAMIN D COMPOUNDS WISCONSIN ALUMNI RES FOUND (US) 2008-06-25 EP disclosed
US-20080032956-A1 2-Ethyl and 2-Ethylidene-19-Nor-Vitamin D Compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-02-07 US disclosed
US-7300925-B2 2-ethyl and 2-ethylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-11-27 US disclosed
WO-2001074766-A1 2-ALKYLIDENE-19-NOR-VITAMIN D COMPOUNDS AND THEIR THERAPEUTIC USES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2001-10-11 WO disclosed
US-20010025036-A1 Method of locking 1alpha-OH of vitamin D compounds in axial orientation HERCULES TECHNOLOGY GROWTH CAPITAL, INC. 2001-09-27 US disclosed
US-6281249-B1 SELECTIVELY TOSYLATING A DIOL; REACTING WITH AN ACETYLENIC COMPOUND; CATALYTIC HYDROGENATION; OXIDATION WISCONSIN ALUMNI RESEARCH FOUNDATION 2001-08-28 US disclosed
US-6277837-B1 TREATMENT OF PSORIASIS, LEUKEMIA, CANCERS, OSTEOPOROSIS WISCONSIN ALUMNI RESEARCH FOUNDATION 2001-08-21 US disclosed
WO-2001042205-A2 TREATMENT OF INFLAMMATORY BOWEL DISEASE WITH VITAMIN D COMPOUNDS THE PENN STATE RESEARCH FOUNDATION (US) 2001-06-14 WO disclosed
EP-1077937-A1 METHOD OF LOCKING 1$g(a)-OH OF VITAMIN D COMPOUNDS IN AXIAL ORIENTATION WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2001-02-28 EP disclosed
EP-0971888-A1 2-ALKYL-19-NOR-VITAMIN D COMPOUNDS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-01-19 EP disclosed
WO-1999059966-A1 METHOD OF LOCKING 1α-OH OF VITAMIN D COMPOUNDS IN AXIAL ORIENTATION WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-11-25 WO disclosed
WO-1999003829-A1 18-SUBSTITUTED-19-NOR-VITAMIN D COMPOUNDS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-01-28 WO disclosed
WO-1998041500-A1 2-ALKYL-19-NOR-VITAMIN D COMPOUNDS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1998-09-24 WO 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 (5 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-20090143342-A1 26,27-homologated-20-EPI-2-alkylidene-19-nor-vitamin D compounds VDR, CYP24A1, CYP2R1 ALDH1A1 2583/4885ALOX15 1537/4885CYP3A4 1432/4885
US-20080032956-A1 2-Ethyl and 2-Ethylidene-19-Nor-Vitamin D Compounds CYP24A1, VDR, CYP2R1 ALDH1A1 1830/4885ALOX15 868/4885CYP3A4 436/4885
US-20100179344-A1 2-Alkylidene-18,19-Dinor-Vitamin D Compounds VDR, CD14, CYP24A1 ALDH1A1 3396/4885ALOX15 1063/4885CYP3A4 2974/4885
US-20110112056-A1 Use of Carbon-2-Modified-Vitamin D Analogs to Induce the Formation of New Bone CYP24A1, VDR, CYP2R1 ALDH1A1 2629/4885ALOX15 1819/4885CYP3A4 377/4885
US-20010025036-A1 Method of locking 1alpha-OH of vitamin D compounds in axial orientation CYP24A1, VDR, CYP2R1 ALDH1A1 2286/4885ALOX15 1121/4885CYP3A4 1124/4885

“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.