SCHEMBL2561245

SCHEMBL2561245

OB(O)c1cccc(COc2ccc(Cl)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.64
MRGPRX4 Q96LA9 1/20 0.58
MAOB P27338 6/20 0.53
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
RXRG P48443 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
ALOX12 P18054 1/20 0.50
HTT P42858 1/20 0.50
MAOA P21397 1/20 0.50
APP P05067 1/20 0.46
ALOX5 P09917 1/20 0.46

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
SCHEMBL2560312 0.88 MRGPRX4 (0.58) ENPP2MRGPRX4MAOBRXRARXRB
SCHEMBL15330536 0.86 NR4A2 (0.56) ENPP2MAOBRXRARXRBRXRG
SCHEMBL31051000 0.86 NR4A2 (0.56) ENPP2MAOBRXRARXRBRXRG
SCHEMBL15331009 0.86 ENPP2 (0.74) ENPP2MRGPRX4MAOBNPC1RAB9A
SCHEMBL30688670 0.85 ENPP2 (0.65) ENPP2MRGPRX4MAOBRAB9ASMN1; SMN2
SCHEMBL29138052 0.85 ENPP2 (0.65) ENPP2MRGPRX4MAOBRAB9ASMN1; SMN2
SCHEMBL2555740 0.85 MRGPRX4 (0.60) ENPP2MRGPRX4MAOBRXRARXRB
SCHEMBL2563261 0.84 MAOB (0.65) ENPP2MAOBRXRARXRBRXRG
SCHEMBL31580896 0.84 MAOB (0.65) ENPP2MAOBRXRARXRBRXRG
SCHEMBL16687434 0.84 ENPP2 (0.68) ENPP2MRGPRX4MAOBRAB9ASMN1; 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