SCHEMBL8947276

SCHEMBL8947276

C[C@@H]1C2CC3C[C@@](C)(C2)C[C@]1(C)C3

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
LMNA P02545 2/20 0.32
SLC22A1 O15245 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
ESR1 P03372 1/20 0.30
ADRB3 P13945 1/20 0.30
ACHE P22303 1/20 0.30
OPRK1 P41145 1/20 0.30
MTOR P42345 1/20 0.30
HTT P42858 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
NFKB1 P19838 1/20 0.30

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
SCHEMBL2547155 1.00 TSHR (0.33) TSHRLMNASLC22A1GRIN2DGRIN3B
SCHEMBL3382502 0.78 TSHR (0.32) TSHRLMNA
SCHEMBL6454576 0.78 TSHR (0.32) TSHRLMNA
SCHEMBL1697138 0.78 LMNA (0.33) TSHRLMNASLC22A1GRIN2DGRIN3B
SCHEMBL1930627 0.78 TSHR (0.32) TSHRLMNA
SCHEMBL4533511 0.76 GRIN1 (0.44) TSHRLMNASLC22A1GRIN2DGRIN3B
SCHEMBL27961178 0.76
Hydrochloric Acid SCHEMBL3284553 0.76 LMNA (0.35) TSHRLMNASLC22A1GRIN2DGRIN3B
SCHEMBL6231101 0.76 PKM (0.38)
Hydrochloric Acid SCHEMBL9118703 0.75 GRIN1 (0.43) TSHRLMNASLC22A1GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117007725-A Column chromatography sample online concentration device, method and application 大庆油田有限责任公司 2023-11-07 CN disclosed
US-5510549-A GREASE COMPRISING DIAMONDOID COMPOUND SELECTED FROM METHYL AND ETHYL SUBSTITUTED ADAMANTANE, DIAMANTANE AND TRIAMANTANE, THICKENER IS SELECTED FROM COLLOIDAL SILICA, FATTY ACID SOAPS, CLAYS AND BENTONITES MOBIL OIL CORPORATION (US) 1996-04-23 US disclosed
WO-1995011873-A1 HIGH PERFORMANCE MIDDLE DISTILLATE FUELS MOBIL OIL CORPORATION (US) 1995-05-04 WO disclosed
WO-1995011472-A1 FIBER OPTIC CABLE AND VISCOUS FILLER MATERIAL MOBIL OIL CORPORATION (US) 1995-04-27 WO disclosed
WO-1995011286-A1 DEPOSIT CONTROL ADDITIVES AND FUEL COMPOSITIONS CONTAINING THE SAME MOBIL OIL CORPORATION (US) 1995-04-27 WO disclosed
US-5400427-A Sheaths with cables, greases in contact with fibers, thickener and diamondoids MOBIL OIL CORPORATION (US) 1995-03-21 US disclosed
US-5334228-A Detergent and carrier fluid of adamantane or di-, tri-, or tetramantane derivative MOBIL OIL CORPORATION (US) 1994-08-02 US disclosed