SCHEMBL9866206

SCHEMBL9866206

O=S(=O)=C1C=C2C=CC=CN2C1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL11269500 0.74 KDM4E (0.38) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL11499500 0.68 KDM4E (0.41) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL28278948 0.67
SCHEMBL7413678 0.63 ALDH1A1 (0.33) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL4554901 0.63 KDM4E (0.36) KDM4EMEN1ALDH1A1MAPTHPGD
Hydrochloric Acid SCHEMBL20262983 0.61 KDM4E (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL16564605 0.61
SCHEMBL27258731 0.60 KDM4E (0.31) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL28021022 0.60 KDM4E (0.31) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL17261368 0.60 KDM4E (0.30) KDM4EMEN1ALDH1A1MAPTHPGD

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-5028710-A Oxidation of corresponding 3-phenylthio indolizine SANOFI (FR) 1991-07-02 US claimed