SCHEMBL2557576

SCHEMBL2557576

CNC(=O)C(C)Oc1ccc(C=O)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 4/20 0.47
ATM Q13315 1/20 0.47
HSD11B1 P28845 1/20 0.46
RECQL P46063 1/20 0.43
ALDH1A1 P00352 9/20 0.42
AOX1 Q06278 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
GFER P55789 1/20 0.38
MAPK1 P28482 2/20 0.36
ALDH1A3 P47895 1/20 0.36
TRIM24 O15164 1/20 0.36
HPGD P15428 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
SCHEMBL15331292 0.84 TSHR (0.47) SMN1; SMN2LMNAATMHSD11B1RECQL
SCHEMBL15332829 0.83 SMN1; SMN2 (0.51) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL2553498 0.83 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1AOX1TSHRKDM4E
SCHEMBL15330014 0.83 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1AOX1TSHRKDM4E
SCHEMBL15330047 0.83 HDAC1 (0.46) SMN1; SMN2LMNAATMHSD11B1RECQL
SCHEMBL15331980 0.80 ALDH5A1 (0.48) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL15330643 0.80 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1KDM4EGAAMAPT
SCHEMBL3631166 0.79 ALDH1A3 (0.52) SMN1; SMN2LMNARECQLALDH1A1AOX1
SCHEMBL15330657 0.78 PTGDR2 (0.49) SMN1; SMN2LMNAATMHSD11B1ALDH1A1
SCHEMBL2555020 0.76 ALDH5A1 (0.47) SMN1; SMN2LMNAALDH1A1MEN1KMT2A

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