SCHEMBL8686519

SCHEMBL8686519

COc1cc(OC)nc(S(=O)(=O)c2ccc(C)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ GAA P10253 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.48
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ RAPGEF4 Q8WZA2 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MCOLN3 Q8TDD5 1/20 0.43
▸ HPGD P15428 2/20 0.43
▸ PKM P14618 1/20 0.41
▸ HTT P42858 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL1720601 0.84 SMN1; SMN2 (0.56) LMNASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL8792718 0.80 SMN1; SMN2 (0.47) LMNASMN1; SMN2GAAALDH1A1RAPGEF4
SCHEMBL10561227 0.78 GAA (0.58) GAAALDH1A1CYP3A4CYP2C19CYP2C9
SCHEMBL10976561 0.73 GAA (0.56) LMNASMN1; SMN2GAAALDH1A1CYP3A4
SCHEMBL1067726 0.71 SMN1; SMN2 (1.00) LMNASMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL8561100 0.71 LMNA (0.61) LMNASMN1; SMN2ALDH1A1KDM4ETSHR
SCHEMBL8793841 0.70 LMNA (0.47) LMNASMN1; SMN2GAAALDH1A1RAPGEF4
SCHEMBL15908246 0.70 PKM (0.83) SMN1; SMN2GAAALDH1A1CYP3A4CYP2C19
SCHEMBL825670 0.70 PKM (0.83) SMN1; SMN2GAAALDH1A1CYP3A4CYP2C19
SCHEMBL13665511 0.70 PKM (0.83) SMN1; SMN2GAAALDH1A1CYP3A4CYP2C19

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
US-5840892-A Process for the preparation of substituted pyrimidines LONZA AG (CH) 1998-11-24 — — US disclosed
EP-0802193-A1 Process for the preparation of substituted pyrimidines LONZA AG (CH) 1997-10-22 — — EP disclosed
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