SCHEMBL2555672

SCHEMBL2555672

Cc1ccc(C)c(SCc2ccccc2B(O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.39
LIPG Q9Y5X9 1/20 0.39
POLB P06746 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.36
APOBEC3A P31941 1/20 0.36
ESR2 Q92731 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CXCR2 P25025 2/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL2561265 0.88 LMNA (0.41) L3MBTL1LMNASMN1; SMN2MAPTLIPG
SCHEMBL2553795 0.78 LIPG (0.39) L3MBTL1LMNASMN1; SMN2MAPTLIPG
SCHEMBL21322250 0.78 L3MBTL1 (0.40) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL3155528 0.78 L3MBTL1 (0.40) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL1200890 0.77 ALDH1A1 (0.42) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL2557991 0.75 LPL (0.46) L3MBTL1LMNASMN1; SMN2LIPGPOLB
SCHEMBL2555471 0.75 ENPP2 (0.46) L3MBTL1LMNASMN1; SMN2LIPGPOLB
SCHEMBL8594581 0.74 LMNA (0.38) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL2557094 0.72 HPGD (0.48) L3MBTL1LMNASMN1; SMN2MAPTMEN1
SCHEMBL29956655 0.72 CXCR2 (0.40) LMNASMN1; SMN2MAPTPOLBKMT2A

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