SCHEMBL30097028

SCHEMBL30097028

Cc1cc2[nH]c(=S)sc2cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 11/20 0.46
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP1A2 P05177 3/20 0.44
GAA P10253 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
GFER P55789 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
GRM1 Q13255 1/20 0.32
UHRF1 Q96T88 1/20 0.31

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
SCHEMBL23706120 1.00 PSMB8 (0.46) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL8781343 0.85 PSMB8 (0.46) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL19153837 0.78 CMA1 (0.44) ALDH1A1
SCHEMBL11110131 0.69 PSMB8 (0.61) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL13740465 0.68 PSMB8 (0.38) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL11478869 0.67 ALDH1A1 (0.60) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL30443775 0.67 ALDH1A1 (0.55) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL12041942 0.67 ALDH1A1 (0.55) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL19039375 0.65 UHRF1 (0.39) ALDH1A1KDM4EHPGDCYP1A2MAPT
SCHEMBL1001304 0.64 ALDH1A1 (0.56) PSMB8ALDH1A1KDM4EHPGDCYP3A4

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
CN-115297861-B Compounds and uses thereof 福宏治疗公司 2024-07-12 CN disclosed
EP-4096667-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 EP disclosed