SCHEMBL15330838

SCHEMBL15330838

CCc1nn(-c2ccccc2Br)c(Cl)c1C=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
OPRM1 P35372 1/20 0.33
CCNE2 O96020 3/20 0.33
CCNE1 P24864 3/20 0.33
CDK2 P24941 3/20 0.33
CDK4 P11802 2/20 0.33
CCND1 P24385 2/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL15332122 0.90 NPC1 (0.34) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15330760 0.86 SMN1; SMN2 (0.46) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL2560316 0.86 PDE4A (0.36) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15330129 0.85 NPSR1 (0.38) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15330768 0.84 KCNN4 (0.39) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15331216 0.82 OPRM1 (0.43) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15330493 0.82 PDE4A (0.41) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL2557282 0.81 MGLL (0.35) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL29953708 0.80 SMN1; SMN2 (0.47) NPSR1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL15329652 0.80 ALDH1A1 (0.40) NPSR1SMN1; SMN2ALDH1A1SLC5A1SLC5A2

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 5 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