SCHEMBL2556545

SCHEMBL2556545

Cc1cc(C=O)cc(C)c1OC(C)C(=O)NC(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
ERN1 O75460 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ALOX12 P18054 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
SCHEMBL2557315 0.86 SRC (0.45) SRCTAS1R3TAS1R1TDP1KMT2A
SCHEMBL2558182 0.82 SRC (0.42) SRCKDM4EL3MBTL1ALDH1A1
SCHEMBL2558786 0.82 SMN1; SMN2 (0.46) SRCTAS1R3TAS1R1ATMKDM4E
SCHEMBL2555873 0.81 TDP1 (0.49) SRCTDP1KMT2AKDM4EHPGD
SCHEMBL2556320 0.80 HPGD (0.49) SRCKMT2AKDM4EHTTHPGD
SCHEMBL2559666 0.80 SRC (0.40) SRCKMT2AKDM4EHTTHPGD
SCHEMBL2559228 0.80 SRC (0.47) SRCTDP1L3MBTL1ALDH1A1
SCHEMBL2562123 0.79 SRC (0.39) SRCTAS1R3TAS1R1KMT2AKDM4E
SCHEMBL2551983 0.79 SRC (0.39) SRCHTTHPGDL3MBTL1ALDH1A1
SCHEMBL2559977 0.78 LMNA (0.54) SRCKMT2AHTTLMNAL3MBTL1

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