SCHEMBL29929142

SCHEMBL29929142

CCCCCCC(C)(C)c1cc(O)c2c(c1)oc(=O)c1ccc(O)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 1.00
CNR1 P21554 13/20 1.00
GPR55 Q9Y2T6 4/20 0.57
GPR18 Q14330 3/20 0.57
HSD17B3 P37058 1/20 0.40

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
SCHEMBL29385133 1.00 CNR2 (1.00) CNR2CNR1GPR55GPR18HSD17B3
SCHEMBL3298491 1.00 CNR2 (1.00) CNR2CNR1GPR55GPR18HSD17B3
SCHEMBL14454507 0.96 CNR2 (0.92) CNR2CNR1GPR55GPR18
SCHEMBL5550044 0.90 CNR2 (0.82) CNR2CNR1GPR55GPR18
SCHEMBL5553151 0.89 CNR2 (0.81) CNR2CNR1GPR55GPR18
SCHEMBL4567352 0.89 CNR2 (0.80) CNR2CNR1GPR55GPR18
SCHEMBL14454514 0.89 CNR2 (0.80) CNR2CNR1GPR55GPR18
SCHEMBL14454500 0.89 CNR2 (0.79) CNR2CNR1GPR55GPR18
SCHEMBL14454509 0.89 CNR2 (0.79) CNR2CNR1GPR55GPR18
SCHEMBL5549479 0.88 CNR2 (0.78) CNR2CNR1GPR55GPR18

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
US-20240315965-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2024-09-26 US claimed
WO-2022182527-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2022-09-01 WO claimed