SCHEMBL1899376

SCHEMBL1899376

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC(O)[C@@H]2O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 7/20 1.00
LMNA P02545 7/20 0.72
HSD17B10 Q99714 5/20 0.72
SERPINA6 P08185 5/20 0.72
TSHR P16473 5/20 0.72
CYP3A4 P08684 5/20 0.72
CYP19A1 P11511 5/20 0.72
MAPK1 P28482 5/20 0.72
SNCA P37840 4/20 0.72
NR3C1 P04150 4/20 0.72
PGR P06401 4/20 0.72
MAPT P10636 4/20 0.72
AR P10275 3/20 0.72
GPBAR1 Q8TDU6 3/20 0.72
SIGMAR1 Q99720 3/20 0.72
CACNA1C Q13936 2/20 0.72
CYP51A1 Q16850 2/20 0.72
OR51E2 Q9H255 1/20 0.72
SMN1; SMN2 Q16637 5/20 0.64
ALDH1A1 P00352 5/20 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
SCHEMBL4102864 1.00 SHBG (1.00) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL1900826 1.00 SHBG (1.00) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL1899372 1.00 SHBG (1.00) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL13752654 1.00 SHBG (1.00) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL4102861 1.00 SHBG (1.00) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL10079003 0.89 SHBG (0.80) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL18075707 0.89 SHBG (0.80) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL572119 0.87 SHBG (0.77) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL18799945 0.87 SHBG (0.77) SHBGLMNAHSD17B10SERPINA6TSHR
SCHEMBL11209693 0.87 SHBG (0.77) SHBGLMNAHSD17B10SERPINA6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197514-A1 PROTEIN CRYSTAL OF HUMAN CYTOCHROME P450 AROMATASE AND USES THEREOF HAUPTMAN-WOODWARD MEDICAL RESEARCH INSTITUTE, INC. (US) 2010-08-05 US claimed
US-7687252-B2 Protein crystal of human cytochrome P450 aromatase and uses thereof Hauptman-Woodward Medcial Research Institute, Inc. (US) 2010-03-30 US claimed
US-20090204378-A1 PROTEIN CRYSTAL OF HUMAN CYTOCHROME P450 AROMATASE AND USES THEREOF HAUPTMAN-WOODWARD MEDICAL RESEARCH INSTITUTE, INC. (US) 2009-08-13 US claimed
WO-2009061859-A2 PROTEIN CRYSTAL OF HUMAN CYTOCHROME P450 AROMATASE AND USES THEREOF HAUPTMAN-WOODWARD MEDICAL RESEARCH INSTITUTE, INC. (US) 2009-05-14 WO claimed
US-20060122158-A1 Pharmaceutical application of 15- or 16-substituted testosterone analogues WILMINGTON TRUST 2006-06-08 US claimed
CN-1694710-A Pharmaceutical use of 15-or 16-substituted testosterone analogues PANTARHEI BIOSCIENCE BV (NL) 2005-11-09 CN claimed
EP-1551415-A1 PHARMACEUTICAL APPLICATION OF 15- OR 16- SUBSTITUTED TESTOSTERONE ANALOGUES Pantarhei Bioscience B.V. (NL) 2005-07-13 EP claimed
WO-2004022065-A1 PHARMACEUTICAL APPLICATION OF 15- OR 16- SUBSTITUTED TESTOSTERONE ANALOGUES PANTARHEI BIOSCIENCE B.V. (NL) 2004-03-18 WO claimed
US-20240165032-A1 DRUG DELIVERY SYSTEM EB IP HYBRITABS B V (NL) 2024-05-23 US disclosed
CN-113980883-B Recombinant escherichia coli for high-yield hydroxylation steroid bulk drug and application thereof 浙江理工大学 2023-11-07 CN disclosed
US-20210290551-A1 DRUG DELIVERY SYSTEM EB IP HYBRITABS B.V. (NL) 2021-09-23 US disclosed
US-10966933-B2 Drug delivery system EB IP HYBRITABS B.V. (NL) 2021-04-06 US disclosed
US-10576127-B2 Irisin for care and prevention of osteoporosis UNIVERSITA' DEGLI STUDI DI BARI (IT) 2020-03-03 US disclosed
EP-3081228-B1 IRISIN FOR CARE AND PREVENTION OF OSTEOPOROSIS UNIV DEGLI STUDI DI BARI (IT) 2018-09-19 EP disclosed
EP-1551415-A1 PHARMACEUTICAL APPLICATION OF 15- OR 16- SUBSTITUTED TESTOSTERONE ANALOGUES Pantarhei Bioscience B.V. (NL) 2005-07-13 EP disclosed
EP-1400564-B1 Polymeric composition, material produced thereof and their applications GKSS FORSCHUNGSZENTRUM (DE) 2005-02-02 EP disclosed
WO-2004024815-A1 POLYMERIC COMPOSITION, MATERIAL PRODUCED THEREOF AND THEIR APPLICATIONS GKSS FORSCHUNGSZENTRUM (DE) 2004-03-25 WO disclosed
EP-1400564-A1 Polymeric composition, material produced thereof and their applications GKSS Forschungszentrum (DE) 2004-03-24 EP disclosed
WO-2004022065-A1 PHARMACEUTICAL APPLICATION OF 15- OR 16- SUBSTITUTED TESTOSTERONE ANALOGUES PANTARHEI BIOSCIENCE B.V. (NL) 2004-03-18 WO disclosed
WO-2004022065-A1 PHARMACEUTICAL APPLICATION OF 15- OR 16- SUBSTITUTED TESTOSTERONE ANALOGUES PANTARHEI BIOSCIENCE B.V. (NL) 2004-03-18 WO disclosed