SCHEMBL2553728

SCHEMBL2553728

Cc1cccc(-n2nc(C(C)C)c(C=O)c2Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 2/20 0.42
MCHR1 Q99705 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
PAX8 Q06710 1/20 0.42
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
NPY5R Q15761 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
RPA1 P27694 1/20 0.37
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
PIK3CD O00329 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL15332053 0.91 NPBWR1 (0.41) NPBWR1MCHR1RAB9ANPC1PAX8
SCHEMBL15330699 0.89 KMT2A (0.45) ALDH1A1LMNATP53MAPTKMT2A
SCHEMBL2555114 0.86 POLB (0.35) NPBWR1MCHR1RAB9AALDH1A1LMNA
SCHEMBL15330943 0.86 DHODH (0.41) LMNATP53MAPTKMT2AMEN1
SCHEMBL2558320 0.86 NPBWR1 (0.37) NPBWR1RAB9AALDH1A1LMNATP53
SCHEMBL29956884 0.85 SMN1; SMN2 (0.47) RAB9ANPC1ALDH1A1LMNATP53
SCHEMBL2563212 0.83 KMT2A (0.49) NPBWR1MCHR1RAB9ANPC1PAX8
SCHEMBL15332190 0.83 MAPT (0.41) RAB9ANPC1ALDH1A1LMNATP53
SCHEMBL29957442 0.83 PIK3CD (0.40) NPBWR1MCHR1RAB9ANPC1ALDH1A1
SCHEMBL2553454 0.82 STAT1 (0.39) RAB9ANPC1ALDH1A1LMNATP53

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