SCHEMBL17834348

SCHEMBL17834348

O=CNCCCN1C(=O)S/C(=C\c2ccc(Sc3nc4ccccc4[nH]3)o2)C1=O

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MYC P01106 16/20 0.75
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
SMN1; SMN2 Q16637 4/20 0.73
HPGD P15428 2/20 0.73
ALDH1A1 P00352 3/20 0.71
LMNA P02545 3/20 0.71
MAPT P10636 2/20 0.71
MAPK1 P28482 2/20 0.71
HTT P42858 2/20 0.63
KDM4E B2RXH2 1/20 0.62
CYP1A2 P05177 1/20 0.62
GLA P06280 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62

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
SCHEMBL17821453 0.89 MYC (0.84) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17821454 0.89 MYC (0.84) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17834346 0.88 MYC (0.86) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL20362861 0.88 MYC (0.82) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17834355 0.86 MYC (1.00) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17821394 0.85 MYC (1.00) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17821392 0.85 MYC (1.00) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17834351 0.84 MEN1 (1.00) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17834253 0.84 MEN1 (1.00) MYCMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17834350 0.84 MEN1 (0.76) MYCMEN1KMT2ASMN1; SMN2HPGD

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-2016094688-A1 FUSED 1,3-AZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-06-16 WO disclosed