SCHEMBL2558050

SCHEMBL2558050

Cc1ccc(SCc2ccc(B(O)O)cc2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.46
LIPG Q9Y5X9 7/20 0.46
CA2 P00918 2/20 0.46
LMNA P02545 3/20 0.38
CA1 P00915 1/20 0.38
F11 P03951 1/20 0.37
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
MGLL Q99685 1/20 0.36
DAO P14920 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL2557991 0.88 LPL (0.46) LPLLIPGCA2LMNACA1
SCHEMBL2555479 0.84 ENPP2 (0.46) LPLLIPGLMNARAB9ANPC1
SCHEMBL2561265 0.75 LMNA (0.41) LIPGLMNARAB9ANPC1SMN1; SMN2
SCHEMBL17508158 0.75 CYP2A6 (0.46) LMNARAB9ANPC1SMN1; SMN2POLB
SCHEMBL2557863 0.73 LPL (0.47) LPLLIPGCA2CA1F11
SCHEMBL15331364 0.72 CXCR1 (0.42) LPLLIPGCA2LMNACA1
SCHEMBL2555471 0.72 ENPP2 (0.46) LPLLIPGLMNASMN1; SMN2POLB
SCHEMBL7691152 0.71 LMNA (0.47) LMNARAB9ANPC1SMN1; SMN2POLB
SCHEMBL29954652 0.70 TAAR1 (0.51) LPLLIPGCA2LMNAF11
SCHEMBL15332422 0.70 HTT (0.64) LPLLIPGLMNARAB9ASMN1; SMN2

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 7 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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed