SCHEMBL23958100

SCHEMBL23958100

CCc1cc(B(O)O)cc(C(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.45
LIPG Q9Y5X9 7/20 0.45
HSPA5 P11021 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
TRPV1 Q8NER1 4/20 0.34
ENPP2 Q13822 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MGLL Q99685 1/20 0.32
TRPA1 O75762 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.31
TYR P14679 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 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
SCHEMBL30002291 0.83 MGLL (0.47) LPLLIPGENPP2MGLL
SCHEMBL17677146 0.83 MGLL (0.47) LPLLIPGENPP2MGLL
SCHEMBL1679450 0.81 GABRA1 (0.52) LPLLIPGGABRA1GABRB2TRPV1
SCHEMBL21787203 0.81 LPL (0.58) LPLLIPGHSPA5TRPV1ENPP2
SCHEMBL3791528 0.81 LPL (0.58) LPLLIPGHSPA5TRPV1ENPP2
SCHEMBL24629496 0.80 LPL (0.41) LPLLIPGENPP2CA1CA2
SCHEMBL3262493 0.79 GABRA1 (0.48) HSPA5GABRA1GABRB2TRPA1CYP2C19
SCHEMBL9934549 0.79 HSPA5 (0.42) HSPA5GABRA1GABRB2TRPA1CYP2C19
SCHEMBL14228428 0.74 HSPA5 (0.40) HSPA5GABRA1GABRB2TRPA1CYP2C19
SCHEMBL3784543 0.74 LPL (0.50) LPLLIPGTRPV1ENPP2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210336176-A1 Light-Emitting Device, Metal Complex, Light-Emitting Apparatus, Electronic Apparatus, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-10-28 US disclosed