SCHEMBL6635388

SCHEMBL6635388

O=C(S)Oc1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
LIPE Q05469 4/20 0.46
HPGD P15428 1/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
PPARA Q07869 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
HTT P42858 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
BCHE P06276 1/20 0.42
ALOX15 P16050 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
Hydrochloric Acid SCHEMBL11851679 0.98 ELANE (0.46) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL56865 0.80 KMT2A (0.50) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL7063178 0.80 ELANE (0.50) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL292790 0.78 ELANE (0.53) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL1254449 0.78 ELANE (0.48) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL59462 0.78 ELANE (0.48) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL81261 0.76 MEN1 (0.52) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL9860326 0.76 CYP11B1 (0.49) ELANELIPEHPGDCYP11B1CYP11B2
SCHEMBL76135 0.76 LMNA (0.64) ELANEHPGDCYP11B1CYP11B2MEN1
SCHEMBL54704 0.76 ELANE (0.47) ELANELIPEHPGDCYP11B1CYP11B2

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
EP-1472219-A1 NOVEL BENZOTHIAZINE AND BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2004-11-03 EP disclosed
WO-2003053978-A1 NOVEL BENZOTHIAZINE AND BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2003-07-03 WO disclosed