SCHEMBL7080225

SCHEMBL7080225

C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)CCC(=O)C(C)C)CC[C@@H]23)C[C@@H](O)C[C@@H]1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 14/20 0.76
ADORA3 P0DMS8 2/20 0.76
SLC6A2 P23975 2/20 0.76
AGTR1 P30556 2/20 0.76
CYP24A1 Q07973 3/20 0.73
MAPT P10636 2/20 0.73
NR1I2 O75469 1/20 0.73
ABCB11 O95342 1/20 0.73
GC P02774 1/20 0.73
PGR P06401 1/20 0.73
RXRA P19793 1/20 0.73
CHRM3 P20309 1/20 0.73
CNR1 P21554 1/20 0.73
HTR2C P28335 1/20 0.73
MAPK1 P28482 1/20 0.73
SLC6A4 P31645 1/20 0.73
ADRA1A P35348 1/20 0.73
PTGS2 P35354 1/20 0.73
OPRD1 P41143 1/20 0.73
OPRK1 P41145 1/20 0.73

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
SCHEMBL30013587 1.00 VDR (0.76) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL26982954 1.00 VDR (0.76) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL7080227 1.00 VDR (0.76) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL8152855 1.00 VDR (0.76) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL3679281 0.92 VDR (0.83) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL29452954 0.90 VDR (0.75) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL19988215 0.90 VDR (0.79) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL8046820 0.90 VDR (0.79) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL7139484 0.90 VDR (0.79) VDRADORA3SLC6A2AGTR1CYP24A1
SCHEMBL19988232 0.90 VDR (0.79) VDRADORA3SLC6A2AGTR1CYP24A1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413828-B1 SOLID PREPARATION OF ACTIVE VITAMIN D3 HAVING IMPROVED STABILITY TEIJIN LTD (JP) 1996-04-17 EP claimed
US-5158944-A Dispersed in excipient readily soluble in organic solvent, and basic substance TEIJIN LIMITED (JP) 1992-10-27 US claimed
EP-0413828-A1 SOLID PREPARATION OF ACTIVE VITAMIN D3 HAVING IMPROVED STABILITY TEIJIN LIMITED (JP) 1991-02-27 EP claimed
EP-2584913-B1 STABILIZED ACTIVE COMPOUND PRAYON S A (BE) 2019-03-20 EP disclosed
US-9757331-B2 Stabilized active compound PRAYON SA (BE) 2017-09-12 US disclosed
US-20130095150-A1 STABILIZED ACTIVE COMPOUND PRAYON S.A. (BE) 2013-04-18 US disclosed
EP-0969849-B1 STABLE SOLID PREPARATION CONTAINING VITAMIN D3 AND TRICALCIUM PHOSPHATE MERCK PATENT GMBH (DE) 2003-07-23 EP disclosed
EP-0969849-A1 STABLE SOLID PREPARATION CONTAINING VITAMIN D3 AND TRICALCIUM PHOSPHATE MERCK PATENT GmbH (DE) 2000-01-12 EP disclosed
WO-1998040085-A1 STABLE SOLID PREPARATION CONTAINING VITAMIN D3 AND TRICALCIUM PHOSPHATE MERCK PATENT GMBH (DE) 1998-09-17 WO disclosed
EP-0413828-B1 SOLID PREPARATION OF ACTIVE VITAMIN D3 HAVING IMPROVED STABILITY TEIJIN LTD (JP) 1996-04-17 EP disclosed
EP-0390930-B1 STABLE AQUEOUS PREPARATION OF ACTIVE VITAMIN D 3 TEIJIN LIMITED (JP) 1993-03-03 EP disclosed
US-5158944-A Dispersed in excipient readily soluble in organic solvent, and basic substance TEIJIN LIMITED (JP) 1992-10-27 US disclosed
EP-0413828-A1 SOLID PREPARATION OF ACTIVE VITAMIN D3 HAVING IMPROVED STABILITY TEIJIN LIMITED (JP) 1991-02-27 EP disclosed
EP-0215596-B1 COMPOSITION FOR INJECTION OF ACTIVE TYPE VITAMINS D3 TEIJIN LIMITED (JP) 1990-12-27 EP disclosed
EP-0390930-A1 STABLE AQUEOUS PREPARATION OF ACTIVE VITAMIN D 3 TEIJIN LIMITED (JP) 1990-10-10 EP disclosed
US-4948788-A FREEZE DRIED ACTIVE MATERIAL AND AN EXCIPIENT; HEAT RESISTANCE PHOTOSTABILITY; STORAGE STABILITY TEIJIN LIMITED (JP) 1990-08-14 US disclosed
US-4871723-A 1A,24-DIHYDROXYCHOLECALCIFEROL; OILY CARRIER; FATTY ACID ESTER , FATTY ALCOHOL OR PROPYLENE CARBONATE AS SOLVENT TEIJIN, LIMITED (JP) 1989-10-03 US disclosed
US-4729895-A STABILITY TEIJIN LIMITED (JP) 1988-03-08 US disclosed