SCHEMBL8920117

SCHEMBL8920117

COC(=O)c1ccc(Cl)cc1NC(=O)CSCCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.54
KDM4E B2RXH2 5/20 0.53
PLA2G2A P14555 1/20 0.51
PRMT5 O14744 1/20 0.51
WDR77 Q9BQA1 1/20 0.51
HPGD P15428 2/20 0.50
TP53 P04637 1/20 0.49
ALDH1A1 P00352 4/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
TSHR P16473 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALOX15 P16050 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL8922901 0.95 MAPT (0.57) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL8921187 0.94 MEN1 (0.56) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL8920196 0.90 MAPT (0.74) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL8921602 0.83 MEN1 (0.61) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL7464454 0.82 L3MBTL1 (0.73) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL8920264 0.82 MEN1 (0.66) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL7466702 0.79 PRMT5 (0.57) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL8921142 0.78 MEN1 (0.58) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL7459655 0.78 ALDH1A1 (0.58) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL7459301 0.78 L3MBTL1 (0.56) MAPTMEN1KMT2ALMNASMN1; SMN2

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-5633379-A N-METHYLASPARTIC ACID ANTAGONIST CIBA-GEIGY CORPORATION (US) 1997-05-27 US disclosed