SCHEMBL20575301

SCHEMBL20575301

C[C@]12C(CC[C@@H]3[C@@H]1CC[C@]1(C)[C@@H](O)CC[C@@H]31)CC(=O)CC2[C@]12[C@@H](O)C[C@@]3(C)[C@@H](CC[C@]3(O)C(=O)CO)[C@@H]1CCC1=CC(=O)CC[C@@]12C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.56
MAPK1 P28482 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP2C19 P33261 4/20 0.46
HIF1A Q16665 5/20 0.46
PGR P06401 4/20 0.46
HRH1 P35367 1/20 0.46
SERPINA6 P08185 5/20 0.46
HSD17B10 Q99714 7/20 0.46
SHBG P04278 5/20 0.46
CYP3A4 P08684 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
NR3C2 P08235 1/20 0.46
NFKB1 P19838 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 4/20 0.45
TSHR P16473 3/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45

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
SCHEMBL2330386 0.86 NR3C1 (0.59) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL8907648 0.80 NR3C1 (0.56) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL94105 0.76 HIF1A (0.63) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL7766720 0.75 HIF1A (0.55) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL2981243 0.75 HSD17B10 (0.60) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL10429009 0.75 NR3C1 (0.76) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL10429011 0.75 NR3C1 (0.76) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL8903198 0.75 NR3C1 (0.79) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL607348 0.75 NR3C1 (0.79) NR3C1MAPK1ALDH1A1CYP2C19HIF1A
SCHEMBL28318620 0.74 HIF1A (0.60) NR3C1MAPK1ALDH1A1CYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118339176-A Engineered myocardial composition 博德研究所 2024-07-12 CN disclosed
EP-4381078-A1 ENGINEERED MUSCLE TARGETING COMPOSITIONS The Broad Institute, Inc. (US) 2024-06-12 EP disclosed
EP-4373837-A2 ENGINEERED TARGETING COMPOSITIONS FOR ENDOTHELIAL CELLS OF THE CENTRAL NERVOUS SYSTEM VASCULATURE AND METHODS OF USE THEREOF The Broad Institute, Inc. (US) 2024-05-29 EP disclosed
CN-118076743-A Engineered muscle targeting compositions 博德研究所 2024-05-24 CN disclosed
US-11920150-B2 Engineered muscle targeting compositions THE BROAD INSTITUTE, INC. (US) 2024-03-05 US disclosed
WO-2024035900-A2 METHODS AND COMPOSITIONS FOR TRANSDUCING HEMATOPOIETIC CELLS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-02-15 WO disclosed
WO-2023004367-A9 ENGINEERED TARGETING COMPOSITIONS FOR ENDOTHELIAL CELLS OF THE CENTRAL NERVOUS SYSTEM VASCULATURE AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. (US) 2024-01-25 WO disclosed
WO-2023225564-A1 ENGINEERED VIRAL CAPSIDS WITH INCREASED STABILITY AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. (US) 2023-11-23 WO disclosed
WO-2023150632-A2 TARGETING MOIETIES PROMOTING TRANSDUCTION OF CENTRAL NERVOUS SYSTEM CELLS AND TISSUES AND METHODS OF USE THE BROAD INSTITUTE, INC. (US) 2023-08-10 WO disclosed
US-20230193316-A1 ENGINEERED CENTRAL NERVOUS SYSTEM COMPOSITIONS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2023-06-22 US disclosed
EP-4028064-A1 ENGINEERED ADENO-ASSOCIATED VIRUS CAPSIDS The Broad Institute, Inc. (US) 2022-07-20 EP disclosed
CN-114729384-A Engineered adeno-associated virus capsids 博德研究所 2022-07-08 CN disclosed
WO-2021222831-A2 ENGINEERED CENTRAL NERVOUS SYSTEM COMPOSITIONS THE BROAD INSTITUTE, INC. (US) 2021-11-04 WO disclosed
WO-2021077000-A1 ENGINEERED MUSCLE TARGETING COMPOSITIONS THE BROAD INSTITUTE, INC. (US) 2021-04-22 WO disclosed
WO-2021050974-A1 ENGINEERED ADENO-ASSOCIATED VIRUS CAPSIDS THE BROAD INSTITUTE, INC. (US) 2021-03-18 WO disclosed
US-10881735-B2 Phase change nanodroplet conjugates for targeted delivery ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-01-05 US disclosed
CN-110573184-A RNA nanostructures, methods of making and uses thereof 俄亥俄州立创新基金会 2019-12-13 CN disclosed
CN-109844109-A TAT κ-CDKL5 fusion protein, its composition, preparation and purposes 万校之母-博洛尼亚大学 2019-06-04 CN disclosed
CN-109196103-A The 3D RNA cage type nanoparticle of self assembly 俄亥俄州立创新基金会 2019-01-11 CN disclosed
US-20180344849-A1 PHASE CHANGE NANODROPLET CONJUGATES FOR TARGETED DELIVERY ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2018-12-06 US disclosed