SCHEMBL15330213

SCHEMBL15330213

CC(C)Cc1nn(-c2ccccc2)c(Cl)c1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
CACNA1H O95180 2/20 0.44
HPGD P15428 1/20 0.43
MAPT P10636 6/20 0.42
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
RECQL P46063 1/20 0.42
MAPK1 P28482 4/20 0.41
HTR6 P50406 3/20 0.41
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
CACNA1G O43497 1/20 0.39
KCNH2 Q12809 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 1/20 0.38

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
SCHEMBL29953708 0.84 SMN1; SMN2 (0.47) SMN1; SMN2HPGDMAPTALDH1A1LMNA
SCHEMBL15331895 0.83 CACNA1H (0.44) CACNA1HALDH1A1LMNANPSR1MAPK1
SCHEMBL29956741 0.82 SMN1; SMN2 (0.45) SMN1; SMN2HPGDMAPTALDH1A1LMNA
SCHEMBL29955028 0.81 GAA (0.45) SMN1; SMN2HPGDMAPTALDH1A1LMNA
SCHEMBL11722253 0.80 NR3C1 (0.40) SMN1; SMN2CACNA1HHPGDMAPTALDH1A1
SCHEMBL29956884 0.78 SMN1; SMN2 (0.47) SMN1; SMN2HPGDMAPTALDH1A1LMNA
SCHEMBL1267498 0.76 SMN1; SMN2 (0.66) SMN1; SMN2HPGDMAPTALDH1A1LMNA
SCHEMBL2558226 0.74 NMT1 (0.36)
SCHEMBL15329814 0.73 NPSR1 (0.42) SMN1; SMN2MAPTALDH1A1LMNANPSR1
SCHEMBL15330993 0.72 MAPT (0.41) SMN1; SMN2HPGDMAPTALDH1A1LMNA

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