SCHEMBL232217

SCHEMBL232217

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

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.74
VDR P11473 4/20 0.74
MEN1 O00255 3/20 0.74
KMT2A Q03164 3/20 0.74
ADORA3 P0DMS8 3/20 0.74
CDC25A P30304 3/20 0.74
ALDH1A1 P00352 2/20 0.74
CYP3A4 P08684 2/20 0.74
ALOX15 P16050 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
PGR P06401 2/20 0.74
TDP1 Q9NUW8 1/20 0.74
HSPD1 P10809 1/20 0.74
HPGD P15428 1/20 0.74
TBXA2R P21731 1/20 0.74
PTGS1 P23219 1/20 0.74
GLRA1 P23415 1/20 0.74
DRD3 P35462 1/20 0.74
HSPE1 P61604 1/20 0.74
HSD17B10 Q99714 1/20 0.74

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
SCHEMBL8003899 1.00 MAPT (0.74) MAPTVDRMEN1KMT2AADORA3
SCHEMBL10034122 1.00 MAPT (0.74) MAPTVDRMEN1KMT2AADORA3
SCHEMBL4960177 0.93 MAPT (0.74) MAPTVDRMEN1KMT2AADORA3
SCHEMBL9330205 0.91 MAPT (0.71) MAPTVDRMEN1KMT2AADORA3
SCHEMBL352251 0.90 MAPT (0.75) MAPTVDRMEN1KMT2AADORA3
SCHEMBL6403771 0.90 MAPT (0.75) MAPTVDRMEN1KMT2AADORA3
SCHEMBL3824860 0.90 MAPT (0.70) MAPTVDRMEN1KMT2AADORA3
SCHEMBL3220709 0.90 MAPT (0.70) MAPTVDRMEN1KMT2AADORA3
SCHEMBL16782349 0.89 MAPT (0.67) MAPTVDRMEN1KMT2AADORA3
SCHEMBL3698818 0.89 MAPT (0.69) MAPTVDRMEN1KMT2AADORA3

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 1276 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135029-A1 COMPOSITIONS AND METHODS FOR INCREASING DIGESTIBILITY OF CALCIUM AND PHOSPHOROUS IN PIGS PREMEX INC (US) 2023-05-04 US claimed
CN-110208435-B Method for simultaneously detecting content of 25-hydroxyvitamin D3 and 25-hydroxyvitamin D2 in human peripheral blood 北京和合医学诊断技术股份有限公司 2023-03-24 CN claimed
EP-3600431-B1 A COMBINATION FOR USE IN THE TREATMENT OF LUNG CANCER LDN PHARMA LTD (GB) 2022-11-23 EP claimed
US-11413253-B2 Nanoparticle delivery systems CELATOR PHARMACEUTICALS, INC. (US) 2022-08-16 US claimed
CN-114755323-A Method and kit for detecting content of fat-soluble vitamins in dried blood paper 北京和合医学诊断技术股份有限公司 2022-07-15 CN claimed
CN-114460314-B Multivitamin D analogue detection kit and detection method 普迈德(北京)科技有限公司 2022-06-24 CN claimed
CN-114460314-A Detection kit and detection method for multivitamin D analogues 普迈德(北京)科技有限公司 2022-05-10 CN claimed
EP-3986154-A1 FEED ADDITIVE FOR REDUCING SOMATIC CELL COUNT DSM IP Assets B.V. (NL) 2022-04-27 EP claimed
US-20220124572-A1 PHARMACEUTICAL COMPOSITIONS JOYDERMA AG (CH) 2022-04-21 US claimed
CN-107920985-B Improved nanoparticle delivery system 塞拉特药物股份有限公司 2022-03-01 CN claimed
WO-1995013062-A1 BUTYRIC ESTER CYTO-DIFFERENTIATING AGENTS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1995-05-18 WO claimed
US-5352781-A Process for precursors to calcitriol and related compounds HOFFMANN-LA ROCHE INC. (US) 1994-10-04 US claimed
EP-0587751-A1 THERAPEUTIC COMPOSITIONS FOR OSTEOINDUCTION THE PROCTER & GAMBLE COMPANY (US) 1994-03-23 EP claimed
EP-0544391-A1 Compositions for topical treatment of psoriasis and atopic dermatitis TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1993-06-02 EP claimed
EP-0129003-B2 COSMETIC AND DERMATOLOGICAL COMPOSITIONS CONTAINING 1-ALPHA-HYDROXYCHOLECALCIFEROL YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 1993-02-24 EP claimed
WO-1992021365-A1 THERAPEUTIC COMPOSITIONS FOR OSTEOINDUCTION THE PROCTER & GAMBLE COMPANY (US) 1992-12-10 WO claimed
EP-0301167-B1 A COMBINATION OF CHOLECALCIFEROL DERIVATIVES FOR THE TREATMENT OF RENAL BONE DISEASE Teva Pharmaceutical Industries Limited (IL) 1992-08-19 EP claimed
US-4997824-A Bone disorders TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1991-03-05 US claimed
EP-0398715-A2 Method of exterminating rodents and other vertebrate pests WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1990-11-22 EP claimed
EP-0301167-A1 A combination of cholecalciferol derivatives for the treatment of renal bone disease Teva Pharmaceutical Industries Limited (IL) 1989-02-01 EP 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 (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-11413253-B2 Nanoparticle delivery systems PAICS, ABCB1, TSG101 MAPT 1574/4885VDR 2622/4885MEN1 2222/4885

“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.