SCHEMBL9753946

SCHEMBL9753946

C/C=C/CSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.59
LMNA P02545 2/20 0.59
HPGD P15428 2/20 0.59
ALDH1A1 P00352 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
PTGES O14684 1/20 0.54
PTGS1 P23219 1/20 0.53
PTGS2 P35354 1/20 0.53
MAPT P10636 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL9753948 1.00 KDM4E (0.59) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9212578 0.91 KDM4E (0.62) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9214196 0.91 KDM4E (0.62) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9212595 0.91 KDM4E (0.62) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL4266835 0.82 ALDH1A1 (0.61) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9663829 0.80 PTGS1 (0.75) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9215071 0.80 KDM4E (0.68) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9213622 0.79 KDM4E (0.48) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL9213632 0.79 KDM4E (0.48) KDM4ELMNAHPGDALDH1A1L3MBTL1
SCHEMBL18106939 0.78 KDM4E (0.64) KDM4ELMNAHPGDALDH1A1L3MBTL1

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-1991009021-A1 IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-06-27 WO disclosed