SCHEMBL7746327

SCHEMBL7746327

O=C1[CH]N(Cc2ccccc2)C(=S)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
GAA P10253 2/20 0.43
POLB P06746 1/20 0.43
ELANE P08246 2/20 0.42
F2 P00734 1/20 0.42
PLG P00747 1/20 0.42
CTSG P08311 1/20 0.42
CMA1 P23946 1/20 0.42
CTRC Q99895 1/20 0.42
CNR1 P21554 2/20 0.42
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
EPHX2 P34913 1/20 0.41
GSK3B P49841 4/20 0.40

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
SCHEMBL7747499 0.83 DDB1 (0.47) MEN1KMT2ADDB1CRBNGAA
SCHEMBL7741931 0.75 MEN1 (0.55) MEN1KMT2ADDB1CRBNGAA
SCHEMBL10649531 0.70 EPHX2 (0.62) MEN1KMT2ADDB1CRBNGAA
SCHEMBL7745982 0.68 GRK5 (0.47) MEN1KMT2ADDB1CRBNGAA
SCHEMBL7746377 0.66 KMT2A (0.56) MEN1KMT2AGAAPOLBELANE
SCHEMBL21359663 0.65 KMT2A (1.00) MEN1KMT2AGAAPOLBELANE
SCHEMBL7747497 0.64 DDB1 (0.56) MEN1KMT2ADDB1CRBNGAA
SCHEMBL20339296 0.63 KMT2A (0.73) MEN1KMT2AGAAPOLBELANE
SCHEMBL17824459 0.63 ELANE (0.61) MEN1KMT2AGAAPOLBELANE
SCHEMBL1253640 0.63 ALDH1A1 (0.55) MEN1KMT2ADDB1CRBNALDH1A1

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-2001027087-A2 PROCESS FOR MAKING BOC-PROTECTED 3-AMINOHYDANTOINS/THIOHYDANTOINS AND 3-AMINODIHYDROURACILS/DIHYDROTHIOURACILS THE PROCTER & GAMBLE COMPANY (US) 2001-04-19 WO disclosed