SCHEMBL1249402

SCHEMBL1249402

C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@]2(C)[C@@H]([C@H](C)/C=C/[C@@](C)(O)C(C)(C)O)CC[C@@H]12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.74
▸ ALOX15 P16050 3/20 0.74
▸ CYP3A4 P08684 3/20 0.74
▸ LMNA P02545 2/20 0.74
▸ HSPD1 P10809 2/20 0.74
▸ PTGS1 P23219 2/20 0.74
▸ HSPE1 P61604 2/20 0.74
▸ ADRA1A P35348 2/20 0.74
▸ AR P10275 1/20 0.74
▸ TSHR P16473 1/20 0.74
▸ CYP2C9 P11712 1/20 0.74
▸ CYP2C19 P33261 1/20 0.74
▸ USP2 O75604 1/20 0.74
▸ ABCB11 O95342 1/20 0.74
▸ ESR1 P03372 1/20 0.74
▸ TST Q16762 1/20 0.74
▸ MAPT P10636 3/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.67
▸ SREBF1 P36956 1/20 0.67
▸ VDR P11473 5/20 0.63

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
SCHEMBL30253339 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL31602211 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL15261726 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL4948460 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL19733279 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL29504071 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL18393817 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL1249404 1.00 ALDH1A1 (0.74) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL5917213 0.93 ALDH1A1 (0.72) ALDH1A1ALOX15CYP3A4LMNAHSPD1
SCHEMBL5917211 0.93 ALDH1A1 (0.72) 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 216 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025108575-A1 METHODS OF SELECTIVE DEPROTECTION AND SYNTHESIS OF TRANSHYDRINDANE- SKELETON-BASED COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 2025-05-30 — — WO claimed
US-20240319212-A1 METHOD OF MEASURING THE ENDOCYTIC VITAMIN D STATUS IMMUNDIAGNOSTIK AG (DE) 2024-09-26 — — US claimed
CN-113311080-B Joint detection method for multiple vitamin D metabolites, detection kit and application thereof 中国医学科学院北京协和医院 2023-02-21 — — CN claimed
EP-3467510-B1 RELEASE REAGENT FOR VITAMIN D COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-10-26 — — EP claimed
EP-3735591-B1 METHOD OF MEASURING THE ENDOCYTIC VITAMIN D STATUS IMMUNDIAGNOSTIK AG (DE) 2022-06-15 — — EP claimed
US-20210072263-A1 METHOD OF MEASURING THE ENDOCYTIC VITAMIN D STATUS IMMUNDIAGNOSTIK AG (DE) 2021-03-11 — — US claimed
EP-3735591-A1 METHOD OF MEASURING THE ENDOCYTIC VITAMIN D STATUS Immundiagnostik AG (DE) 2020-11-11 — — EP claimed
EP-3327442-B1 RELEASE REAGENT FOR VITAMIN D COMPOUNDS HOFFMANN LA ROCHE (CH) 2020-04-01 — — EP claimed
US-20200072854-A1 RELEASE REAGENT FOR VITAMIN D COMPOUNDS ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2020-03-05 — — US claimed
WO-2019134948-A1 METHOD OF MEASURING THE ENDOCYTIC VITAMIN D STATUS IMMUNDIAGNOSTIK AG (DE) 2019-07-11 — — WO claimed
EP-2515913-A2 USE OF VITAMIN D GLYCOSIDES AND SULFATES FOR TREATMENT OF DISEASE Glycomyr Inc. (US) 2012-10-31 — — EP claimed
WO-2012058614-A1 LC-MS SEPARATION AND DETECTION OF VITAMIN D METABOLITES COHESIVE TECHNOLOGIES INC. (US) 2012-05-03 — — WO claimed
WO-2011079249-A2 USE OF VITAMIN D GLYCOSIDES AND SULFATES FOR TREATMENT OF DISEASE GLYCOMYR, INC. (US) 2011-06-30 — — WO claimed
US-20110152207-A1 USE OF VITAMIN D GLYCOSIDES AND SULFATES FOR TREATMENT OF DISEASE GOFF JESSE P 2011-06-23 — — US claimed
US-20080038374-A1 New Use LIPOPEPTIDE AB (SE) 2008-02-14 — — US claimed
EP-0587751-A1 THERAPEUTIC COMPOSITIONS FOR OSTEOINDUCTION THE PROCTER & GAMBLE COMPANY (US) 1994-03-23 — — EP claimed
EP-0112332-B1 VITAMIN D GLYCOSIDES THE GENERAL HOSPITAL CORPORATION (US) 1993-06-16 — — EP claimed
WO-1992021365-A1 THERAPEUTIC COMPOSITIONS FOR OSTEOINDUCTION THE PROCTER & GAMBLE COMPANY (US) 1992-12-10 — — WO claimed
EP-0077353-A1 1-HYDROXYLATION PROCESS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1983-04-27 — — EP claimed
WO-1982003864-A1 1-HYDROXYLATION PROCESS WISCONSIN ALUMNI RES FOUND (US) 1982-11-11 — — WO 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 (2 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-20110152207-A1 USE OF VITAMIN D GLYCOSIDES AND SULFATES FOR TREATMENT OF DISEASE CYP24A1, VDR, CYP2R1 ALDH1A1 2778/4885ALOX15 949/4885CYP3A4 193/4885
US-20200072854-A1 RELEASE REAGENT FOR VITAMIN D COMPOUNDS GC, VDR, CYP24A1 ALDH1A1 3082/4885ALOX15 2188/4885CYP3A4 2390/4885

“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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