SCHEMBL2554739

SCHEMBL2554739

O=Cc1c(-c2ccc(F)c(F)c2)nn(-c2ccccc2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
RECQL P46063 1/20 0.38
GRM5 P41594 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL2559095 0.90 MEN1 (0.41) NPSR1SMN1; SMN2MEN1KMT2AUSP2
SCHEMBL2558886 0.89 AHR (0.35) MEN1KMT2AUSP2CYP1A2CYP3A4
SCHEMBL2554956 0.87 GAA (0.41) NPSR1GAARAB9ANPC1SMN1; SMN2
SCHEMBL2556378 0.86 HPGD (0.36) KMT2AUSP2CYP1A2CYP3A4CYP2C9
SCHEMBL15331256 0.86 PDE4A (0.47) RAB9ANPC1SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL11725935 0.85 POLB (0.52) NPSR1GAARAB9ANPC1SMN1; SMN2
SCHEMBL11726863 0.85 NPSR1 (0.56) NPSR1GAARAB9ANPC1SMN1; SMN2
SCHEMBL15332526 0.85 CFTR (0.45) NPSR1GAARAB9ANPC1SMN1; SMN2
SCHEMBL15331218 0.85 GRM5 (0.40) NPSR1RAB9ANPC1SMN1; SMN2USP2
SCHEMBL2557352 0.85 CA1 (0.39) NPSR1GAAMEN1KMT2AUSP2

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