SCHEMBL8727286

SCHEMBL8727286

C=CCC(C)CCC(=CCCCCCC)CC(C)CC=C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
FAAH O00519 3/20 0.33
EP300 Q09472 1/20 0.33
PPARG P37231 6/20 0.33
PPARA Q07869 4/20 0.33
TERT O14746 3/20 0.33
PTPN1 P18031 3/20 0.33
PPARD Q03181 3/20 0.33
CYP1A2 P05177 2/20 0.33
MAPT P10636 2/20 0.33
CYP2C19 P33261 2/20 0.33
BLM P54132 2/20 0.33
HSD17B10 Q99714 2/20 0.33
FABP4 P15090 2/20 0.33
KMT2A Q03164 2/20 0.33
GMNN O75496 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL1793053 1.00 TSHR (0.39) TSHRFFAR1FFAR4FAAHEP300
SCHEMBL1645501 1.00 TSHR (0.39) TSHRFFAR1FFAR4FAAHEP300
SCHEMBL10915525 0.90 TSHR (0.48) TSHRFAAHEP300PPARGPPARA
SCHEMBL11406498 0.87 TSHR (0.36) TSHR
SCHEMBL6748775 0.87 TSHR (0.44) TSHRFAAHEP300TERTCYP1A2
SCHEMBL3675070 0.87 TSHR (0.44) TSHRFAAHEP300TERTCYP1A2
SCHEMBL9864075 0.84 ALDH1A1 (0.32) TSHR
SCHEMBL1539785 0.84 ALDH1A1 (0.32) TSHR
SCHEMBL9491466 0.82 TSHR (0.47) TSHRFAAHPPARGPPARATERT
SCHEMBL11507437 0.82 TSHR (0.41) TSHRMAPTUSP2LMNARECQL

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-0852603-A1 PROCESS FOR PRODUCING SILANE-CROSSLINKED POLYOLEFIN SUMITOMO BAKELITE COMPANY LIMITED (JP) 1998-07-15 EP disclosed
WO-1997012936-A1 PROCESS FOR PRODUCING SILANE-CROSSLINKED POLYOLEFIN SUMITOMO BAKELITE COMPANY LIMITED (JP) 1997-04-10 WO disclosed