SCHEMBL27761069

SCHEMBL27761069

CCCCNC(=S)Nc1cccc(Cl)c1O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.62
SMN1; SMN2 Q16637 5/20 0.59
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LMNA P02545 5/20 0.55
MAPT P10636 1/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 1/20 0.51
RECQL P46063 1/20 0.50
ALPL P05186 1/20 0.48
ALPI P09923 1/20 0.48
ALOX12 P18054 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL4356036 0.96 HTT (0.60) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL27782813 0.83 SMN1; SMN2 (0.76) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL27782809 0.83 POLB (0.61) HTTSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL17956821 0.82 HTT (0.60) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4356054 0.79 MAPK1 (0.70) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4350067 0.79 SMN1; SMN2 (0.70) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4357568 0.79 EPHX1 (0.58) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL4350868 0.76 SMN1; SMN2 (0.55) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL15894091 0.75 LMNA (0.83) HTTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4341984 0.75 GAA (0.65) HTTSMN1; SMN2MEN1KMT2ALMNA

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
CN-100546977-C Suppress the new compound and the application thereof of rotamase JERINI AG (DE) 2009-10-07 CN claimed