SCHEMBL8765452

SCHEMBL8765452

CC1(C/C=C/C(=O)O)CO1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
GABRR1 P24046 2/20 0.38
GABRR2 P28476 2/20 0.38
BLM P54132 2/20 0.38
GABRR3 A8MPY1 1/20 0.38
LMNA P02545 1/20 0.38
APEX1 P27695 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RXRA P19793 4/20 0.33
RXRG P48443 4/20 0.33
RARA P10276 2/20 0.32
RARB P10826 2/20 0.32
RARG P13631 2/20 0.32
TP53 P04637 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
ALOX5 P09917 2/20 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
SCHEMBL8765456 1.00 TSHR (0.38) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL14798045 0.74 TSHR (0.41) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL2503574 0.74 TSHR (0.41) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL2874822 0.71 CD81 (0.39) ALOX5
SCHEMBL4147849 0.71 CD81 (0.39) ALOX5
SCHEMBL2467404 0.71 GABRR1 (0.34) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL7876129 0.69 HCAR2 (0.50) TSHRTDP1TP53EGLN1EGLN3
SCHEMBL9715874 0.68 GABRR1 (0.35) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL9754784 0.68 GABRR1 (0.35) TSHRGABRR1GABRR2BLMGABRR3
SCHEMBL5573528 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505972-B1 Process for producing styrenic copolymer IDEMITSU KOSAN CO (JP) 1997-06-11 EP disclosed
EP-0505972-A2 Process for producing styrenic copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 EP disclosed