SCHEMBL23570367

SCHEMBL23570367

O=C(OCc1ccccc1)c1nn(S(=O)(=O)c2ccccc2)c2cccnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ PKM P14618 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL23570044 0.84 KDM4E (0.45) MAPTKDM4EMAOBADORA2ALMNA
SCHEMBL23569883 0.76 KMT2A (0.44) MAPTKDM4ERAB9AKMT2APKM
SCHEMBL19808952 0.69 TDP1 (0.59) EGLN1POLBL3MBTL1MAPTKDM4E
SCHEMBL20154228 0.68 MAPT (0.57) L3MBTL1MAPTKDM4EMAOBADORA2A
SCHEMBL1551668 0.68 PKM (0.69) EGLN1POLBL3MBTL1KDM4ETSHR
SCHEMBL28566933 0.68 POLB (0.65) EGLN1POLBL3MBTL1MAPTKDM4E
SCHEMBL28041139 0.68 POLB (0.57) EGLN1POLBL3MBTL1MAPTKDM4E
SCHEMBL2835796 0.68 POLB (0.57) EGLN1POLBL3MBTL1TSHRCASP3
SCHEMBL20201222 0.68 POLB (0.57) EGLN1POLBL3MBTL1MAPTKDM4E
SCHEMBL23996876 0.67 POLB (0.56) EGLN1POLBL3MBTL1MAPTKDM4E

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
WO-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 — — WO disclosed
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