SCHEMBL5718754

SCHEMBL5718754

Cc1cccc(-c2c(Cl)nc(C#N)n2S(=O)(=O)N(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 6/20 0.36
HPGD P15428 4/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
TSHR P16473 4/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
KDM4E B2RXH2 3/20 0.33
PBRM1 Q86U86 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MDM2 Q00987 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL8430909 0.87 TSHR (0.49) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
Cyazofamid SCHEMBL16180421 0.85 PTGS2 (0.38) SMN1; SMN2KMT2AMEN1TSHRCYP11B1
Cyazofamid SCHEMBL23804496 0.83 PTGS2 (0.37) SMN1; SMN2KMT2AMEN1TSHRCYP11B1
SCHEMBL9519740 0.82 PTGS2 (0.39) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL1073894 0.80 PTGS2 (0.46) SMN1; SMN2TSHRKDM4ELMNAHTT
SCHEMBL1074601 0.78 TSHR (0.34) SMN1; SMN2HPGDKMT2ATSHRTP53
SCHEMBL1074589 0.78 PTGS1 (0.41) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
Cyazofamid SCHEMBL16910348 0.76 PTGS2 (0.32) SMN1; SMN2TSHR
SCHEMBL7095742 0.74 PTGS2 (0.37) ALDH1A1KMT2AMEN1CYP11B1CYP11B2
SCHEMBL9519745 0.72 SMN1; SMN2 (0.33) SMN1; SMN2KDM4EGAA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732385-A1 USE OF (3-(1-(3-PHENYL-PROPENYL)-PIPERIDIN-4-YL)-2,3-DIHYDRO-INDOL-1-YL)-(PYRIDIN-4-YL)-METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INSECTICIDES Syngenta Participations AG (CH) 2006-12-20 EP disclosed
EP-1697376-A1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES Syngenta Participations AG (CH) 2006-09-06 EP disclosed
EP-1694677-A1 SPIROPIPERIDINE DERIVATIVES FOR CONTROLLING PESTS Syngenta Participations AG (CH) 2006-08-30 EP disclosed
WO-2005061512-A1 SPIRO-CONDENSED INDOLINE DERIVATES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2005-07-07 WO disclosed
WO-2005061500-A1 SPIROPIPERIDINE DERIVATIVES FOR CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2005-07-07 WO disclosed
WO-2005058035-A1 USE OF (3-(1-(3-PHENYL-PROPENYL)-PIPERIDIN-4-YL)-2,3-DIHYDRO-INDOL-1-YL)-(PYRIDIN-4-YL)-METHANONE DERIVATIVES AND RELATED COMPOUNDS AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2005-06-30 WO disclosed
WO-2001055142-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed