SCHEMBL1122877

SCHEMBL1122877

C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)CC(O)[C@@]12F

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.79
CYP3A4 P08684 7/20 0.79
LMNA P02545 5/20 0.79
ALDH1A1 P00352 1/20 0.79
NR3C1 P04150 7/20 0.73
HSD17B10 Q99714 4/20 0.73
PGR P06401 4/20 0.73
NFKB1 P19838 3/20 0.73
CYP2C9 P11712 2/20 0.73
PMP22 Q01453 2/20 0.73
CYP2J2 P51589 1/20 0.73
BLM P54132 1/20 0.73
CYP2C19 P33261 1/20 0.73
TSHR P16473 2/20 0.71
AR P10275 2/20 0.71
MEN1 O00255 1/20 0.71
CYP2D6 P10635 1/20 0.71
KMT2A Q03164 1/20 0.71
APEX1 P27695 1/20 0.71
NPSR1 Q6W5P4 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
SCHEMBL94367 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL9654452 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL17884670 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL13657566 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL17665286 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL3764416 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL19715951 1.00 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL11856116 0.92 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL11856120 0.92 HIF1A (0.79) HIF1ACYP3A4LMNAALDH1A1NR3C1
SCHEMBL11845795 0.91 CYP3A4 (0.77) HIF1ACYP3A4LMNAALDH1A1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110612119-A Phospholipid ether (PLE) CAR T cell tumor targeting (CTCT) agents 西雅图儿童医院(DBA西雅图儿童研究所) 2019-12-24 CN claimed
US-20190000862-A1 METHODS AND SYSTEMS FOR THE DELIVERY OF A THERAPEUTIC AGENT HANANJA EHF (IS) 2019-01-03 US claimed
WO-2018148224-A1 PHOSPHOLIPID ETHER (PLE) CAR T CELL TUMOR TARGETING (CTCT) AGENTS Seattle Children's Hospital (dba Seattle Children's Research Institute) (US) 2018-08-16 WO claimed
US-20080038219-A1 Novel Composition for a Topical Skin Treatment Base and Medicated Applications Thereof CALGENEX CORPORATION (US) 2008-02-14 US claimed
US-20070184114-A1 Formulation for topical non-invasive application in vivo IDEA AG (DE) 2007-08-09 US claimed
US-7175850-B2 Formulation for topical non-invasive application in vivo IDEA AG (DE) 2007-02-13 US claimed
EP-1140021-B1 IMPROVED FORMULATION FOR TOPICAL NON-INVASIVE APPLICATION IN VIVO IDEA AG (DE) 2004-08-04 EP claimed
JP-2002533379-A 2002-10-08 JP claimed
US-20020064524-A1 Formulation for topical non-invasive application in vivo IDEA AG (DE) 2002-05-30 US claimed
EP-1140021-A1 IMPROVED FORMULATION FOR TOPICAL NON-INVASIVE APPLICATION IN VIVO IDEA AG (DE) 2001-10-10 EP claimed
WO-2000038653-A1 IMPROVED FORMULATION FOR TOPICAL NON-INVASIVE APPLICATION IN VIVO IDEA AG. (DE) 2000-07-06 WO claimed
EP-0186948-B1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 17ALPHA-HYDROXYPROGESTERONES AND CORTICOIDS FROM AN ENOL STEROID THE UPJOHN COMPANY (US) 1989-01-25 EP claimed
EP-0186948-A1 Process and intermediates for the preparation of 17alpha-hydroxyprogesterones and corticoids from an enol steroid THE UPJOHN COMPANY (US) 1986-07-09 EP claimed
US-20240226160-A9 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-07-11 US disclosed
US-20240210288-A1 Representative Diagnostics VENTANA MED SYST INC (US) 2024-06-27 US disclosed
US-20240131072-A1 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-04-25 US disclosed
US-4181669-A A CARBODIIMIDE WITH ACID CATALYSTS AS A CONDENSATION AGENT AKTIEBOLAGET LEO (SE) 1980-01-01 US disclosed
US-4180504-A Method for the preparation of esters AKTIEBOLAGET LEO (SE) 1979-12-25 US disclosed
US-4036831-A Trimethyl siloxane steroid intermediates STEROID DEVELOPMENT COMPANY ESTABLISHMENT (CH) 1977-07-19 US disclosed
US-3984544-A Retinoic acid esters of steroids of the pregnane series, their use in the treatment of acne and pharmaceutical formulations useful therefor SCHERING CORPORATION (US) 1976-10-05 US 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 (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-20190000862-A1 METHODS AND SYSTEMS FOR THE DELIVERY OF A THERAPEUTIC AGENT TMEM205, NUP205, PIGS HIF1A 428/4885CYP3A4 4715/4885LMNA 458/4885
US-20020064524-A1 Formulation for topical non-invasive application in vivo CUTA, LPO, GPX4 HIF1A 2297/4885CYP3A4 1398/4885LMNA 3910/4885
US-20070184114-A1 Formulation for topical non-invasive application in vivo GPX4, LPO, MMP8 HIF1A 2483/4885CYP3A4 950/4885LMNA 2582/4885

“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.