SCHEMBL15330682

SCHEMBL15330682

OB(O)c1ccc(C(F)(F)F)nc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 7/20 0.44
TDP2 O95551 1/20 0.38
ALPI P09923 1/20 0.38
ACP1 P24666 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
GRM2 Q14416 1/20 0.37
PTGS2 P35354 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
TP53 P04637 1/20 0.36
KIF11 P52732 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
DHODH Q02127 1/20 0.35
MGAT2 Q10469 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL2557332 0.84 GRM2 (0.40) SCN5ATDP2ACP1ADORA3GRM2
SCHEMBL2560758 0.84 XDH (0.40) GRM2SCN10ACYP1A2
SCHEMBL2559188 0.82 MGLL (0.43) KIF11DHODH
SCHEMBL17407883 0.78 SCN5A (0.47) SCN5ATDP2ALPIADORA3PTGS2
SCHEMBL21352386 0.75 POLB (0.45) SCN10A
SCHEMBL2558031 0.74 SCN5A (0.43) SCN5AACP1ADORA3GRM2SCN10A
SCHEMBL2561424 0.73 TRPV1 (0.42) SCN5AGRM2SCN10ATRPV1KIF11
SCHEMBL2553990 0.72 SCN5A (0.47) SCN5AACP1ADORA3SCN10ATP53
SCHEMBL2556002 0.72 RAB9A (0.43) SCN5ASCN10ATRPV1SCN1ASCN2A
SCHEMBL2556074 0.71 TRPV1 (0.46) SCN5AGRM2SCN10ATRPV1NISCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed