SCHEMBL15330219

SCHEMBL15330219

CCc1nn(-c2cccc([N+](=O)[O-])c2)c(Cl)c1C=O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.45
PDE4D Q08499 2/20 0.45
ABHD16A O95870 1/20 0.44
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
MAPK14 Q16539 3/20 0.42
DDR2 Q16832 1/20 0.42
MAPT P10636 4/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL15333149 0.85 MAPT (0.44) ALDH1A1POLBRAB9ASMN1; SMN2NPC1
SCHEMBL15331490 0.84 SMN1; SMN2 (0.53) PDE4BPDE4DABHD16APDE4APDE4C
SCHEMBL2558728 0.84 ALDH1A1 (0.48) PDE4BPDE4DABHD16AALDH1A1POLB
SCHEMBL15331454 0.84 KMT2A (0.47) PDE4BPDE4DPDE4APDE4CALDH1A1
SCHEMBL15329559 0.82 NPBWR1 (0.42) PDE4BPDE4DPDE4APDE4CALDH1A1
SCHEMBL2560455 0.81 KMT2A (0.38) ALDH1A1POLBRAB9ASMN1; SMN2MAPT
SCHEMBL15331661 0.81 DHODH (0.42) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL29953708 0.80 SMN1; SMN2 (0.47) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL2560438 0.79 RAB9A (0.50) ABHD16AALDH1A1POLBRAB9ASMN1; SMN2
SCHEMBL15332201 0.78 NPBWR1 (0.40) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT

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