SCHEMBL9508467

SCHEMBL9508467

O=C(O)C=CCC=CCOCC=CCC=CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.46
TSHR P16473 3/20 0.44
GABRR1 P24046 2/20 0.44
GABRR2 P28476 2/20 0.44
BLM P54132 2/20 0.44
GABRR3 A8MPY1 1/20 0.44
LMNA P02545 1/20 0.44
APEX1 P27695 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PPARA Q07869 1/20 0.39
TP53 P04637 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
HCAR2 Q8TDS4 5/20 0.33
FFAR1 O14842 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
CYP19A1 P11511 1/20 0.31
RXRA P19793 1/20 0.31

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
SCHEMBL28726001 0.87 TSHR (0.50) PTGS1TSHRGABRR1GABRR2BLM
SCHEMBL3065183 0.84 TSHR (0.58) PTGS1TSHRGABRR1GABRR2BLM
SCHEMBL3065185 0.84 TSHR (0.58) PTGS1TSHRGABRR1GABRR2BLM
SCHEMBL1809605 0.81 TSHR (0.61) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL4073778 0.78 TSHR (0.42) TSHRGABRR1GABRR2BLMGABRR3
Ammonia Solution, Strong SCHEMBL38659341 0.78 TSHR (0.58) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL9288862 0.76 TSHR (0.41) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL2261089 0.73
SCHEMBL15751130 0.73
SCHEMBL5349079 0.72 PPARA (0.67) PTGS1TSHRGABRR1GABRR2BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0271876-B1 COATING COMPOSITION AND COATED PRODUCT ASAHI GLASS COMPANY LTD. (JP) 1993-09-29 EP disclosed
US-4861667-A Coating composition and coated product ASAHI GLASS COMPANY, LTD. (JP) 1989-08-29 US disclosed
EP-0271876-A2 Coating composition and coated product ASAHI GLASS COMPANY LTD. (JP) 1988-06-22 EP disclosed