SCHEMBL7545703

SCHEMBL7545703

Cc1cn(-c2ccc(Cl)cc2)c(=O)[nH]c1=S

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
POLB P06746 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
APOBEC3G Q9HC16 1/20 0.40
PKM P14618 1/20 0.40
MAPT P10636 5/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
BRAF P15056 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
MCL1 Q07820 1/20 0.38
KDM4E B2RXH2 2/20 0.37
THRB P10828 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL28744936 0.68 CRBN (0.66) KMT2AHPGDSMN1; SMN2POLBTDP1
SCHEMBL10105030 0.67 CRBN (0.39) SMN1; SMN2RXFP1
SCHEMBL22571159 0.67 ALDH1A1 (0.34) HPGDPOLBMAPTALDH1A1GAA
SCHEMBL23296150 0.67 PKM (0.45) KMT2AHPGDSMN1; SMN2POLBPKM
SCHEMBL7830376 0.67 ALDH1A1 (0.47) KMT2AHPGDSMN1; SMN2PKMMAPT
SCHEMBL11245813 0.67 L3MBTL1 (0.68) KMT2AHPGDSMN1; SMN2TDP1ALDH1A1
SCHEMBL7834516 0.66 HPGD (0.54) KMT2AHPGDSMN1; SMN2PKMMAPT
SCHEMBL20577849 0.65 ATM (0.48) KMT2AHPGDSMN1; SMN2PKMMAPT
SCHEMBL23345942 0.65 PKM (0.43) KMT2AHPGDSMN1; SMN2POLBPKM
SCHEMBL5330807 0.64 PKM (0.42) KMT2AHPGDSMN1; SMN2POLBPKM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165554-A1 NEW ENDOTHELIN CONVERTING ENZYME INHIBITORS, THEIR PRODUCTION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2002-01-02 EP disclosed
WO-2000061579-A1 NEW ENDOTHELIN CONVERTING ENZYME INHIBITORS, THEIR PRODUCTION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2000-10-19 WO disclosed