SCHEMBL29956741

SCHEMBL29956741

CCCc1nn(-c2ccccc2)c(Cl)c1C=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.45
ALDH1A1 P00352 8/20 0.43
LMNA P02545 7/20 0.43
MAPT P10636 6/20 0.43
NPSR1 Q6W5P4 3/20 0.43
RECQL P46063 2/20 0.43
HTT P42858 2/20 0.41
MAPK1 P28482 4/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.40
TP53 P04637 2/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL15330703 0.89 MAPT (0.40) SMN1; SMN2ALDH1A1LMNAMAPTRAB9A
SCHEMBL29953708 0.88 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL15330211 0.88 KMT2A (0.47) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL29958073 0.87 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL15332498 0.87 MAPT (0.40) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL15331272 0.86 MAPT (0.43) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL15329903 0.86 MAPT (0.38) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL15332007 0.85 KMT2A (0.41) SMN1; SMN2ALDH1A1LMNAMAPTRAB9A
SCHEMBL15329638 0.84 HTT (0.43) SMN1; SMN2LMNAMAPTHTTTP53
SCHEMBL15330043 0.84 KMT2A (0.39) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1

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 1 patent. 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