SCHEMBL20503264

SCHEMBL20503264

CCCC=COC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
TSHR P16473 5/20 0.46
F2 P00734 1/20 0.44
TDP1 Q9NUW8 4/20 0.42
SLC6A3 Q01959 2/20 0.41
HTR1A P08908 1/20 0.41
CYP2D6 P10635 1/20 0.41
SCN1A P35498 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 2/20 0.41
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
HIF1A Q16665 1/20 0.41
SLC6A2 P23975 1/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
CYP1A2 P05177 2/20 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
SCHEMBL20503355 1.00 LMNA (0.51) LMNATSHRF2TDP1SLC6A3
SCHEMBL8836430 0.91 TSHR (0.42) LMNATSHRTDP1CYP2D6KMT2A
SCHEMBL7934397 0.90 LMNA (0.49) LMNATSHRF2TDP1CYP2D6
SCHEMBL7934395 0.90 LMNA (0.49) LMNATSHRF2TDP1CYP2D6
SCHEMBL6551288 0.89 LMNA (0.47) LMNATSHRTDP1KMT2AMAPK1
SCHEMBL27866085 0.88 SMN1; SMN2 (0.39) LMNATSHRKMT2AMEN1SMN1; SMN2
SCHEMBL22439055 0.87 SOAT2 (0.49) LMNATSHRTDP1KMT2ACES2
SCHEMBL21528269 0.87 SOAT2 (0.49) LMNATSHRTDP1KMT2ACES2
SCHEMBL6552638 0.87 SOAT2 (0.49) LMNATSHRTDP1KMT2ACES2
SCHEMBL6552841 0.87 SOAT2 (0.49) LMNATSHRTDP1KMT2ACES2

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-20230051453-A1 BIOSYNTHETIC PLATFORM FOR THE PRODUCTION OF OLIVETOLIC ACID AND ANALOGUES OF OLIVETOLIC ACID THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-02-16 US disclosed
EP-3377473-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX Pharmaceuticals, Inc. (US) 2018-09-26 EP disclosed