SCHEMBL9953403

SCHEMBL9953403

O=S(=O)(Cc1ccccc1)c1cc(Br)cnc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 3/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MTOR P42345 1/20 0.46
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL25886719 0.78 ALPL (0.44) ALPLALDH1A1MAPTNPSR1LMNA
SCHEMBL30989718 0.78 ALPL (0.44) ALPLALDH1A1MAPTNPSR1LMNA
SCHEMBL28274692 0.75 TSHR (0.50) ALDH1A1MAPTRAB9ANPSR1MTOR
SCHEMBL10972259 0.74 MAPT (0.49) ALDH1A1MAPTMTORHPGDLMNA
SCHEMBL2414267 0.74 CA1 (0.50) ALDH1A1MAPTRAB9ANPSR1MTOR
SCHEMBL10288674 0.73 ALPL (0.70) ALPLMAPTKMT2ANPC1
SCHEMBL1960956 0.73 KMT2A (0.45) ALPLALDH1A1MAPTRAB9ALMNA
SCHEMBL789628 0.72 ALPL (0.47) ALPLALDH1A1MAPTNPSR1LMNA
SCHEMBL12909455 0.71 FEN1 (0.45) ALDH1A1MAPTMTORHPGDLMNA
SCHEMBL2492632 0.71 GCK (0.49) ALDH1A1RAB9AHTTSMN1; SMN2

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
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed