SCHEMBL7782990

SCHEMBL7782990

CCOCn1c(Sc2ccc(Cl)c(Cl)c2)c(Br)c(C#N)c1-c1ccc(Cl)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
NPSR1 Q6W5P4 3/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RXFP1 Q9HBX9 2/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
GRIA2 P42262 1/20 0.30
GRIA4 P48058 1/20 0.30

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
SCHEMBL7782866 0.92 NPSR1 (0.35) AKR1B1PTGDR2NPSR1MEN1KMT2A
SCHEMBL7783612 0.83 MAPK1 (0.37) AKR1B1PTGDR2NPSR1TDP1L3MBTL1
SCHEMBL7778321 0.80 PTGDR2 (0.35) AKR1B1PTGDR2MEN1KMT2ARXFP1
SCHEMBL7777931 0.80 MAOA (0.38) AKR1B1PTGDR2MEN1KMT2ATDP1
SCHEMBL678557 0.78 KMT2A (0.41) NPSR1MEN1KMT2ARXFP1MAPT
SCHEMBL27810755 0.75 GRIA2 (0.34) NPSR1MEN1KMT2ARXFP1KDM4E
Chlorfenapyr SCHEMBL40337 0.74 RXFP1 (0.35) MEN1KMT2ARXFP1MAPTKDM4E
SCHEMBL5819704 0.73 CTSS (0.33) NPSR1MEN1KMT2ARXFP1HPGD
Chlorfenapyr SCHEMBL28530561 0.73 RXFP1 (0.35) MEN1KMT2ARXFP1MAPTKDM4E
Chlorfenapyr SCHEMBL27488880 0.73 RXFP1 (0.35) MEN1KMT2ARXFP1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0801058-B1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID CO (US) 2001-10-10 EP disclosed
US-5817691-A Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID COMPANY (US) 1998-10-06 US disclosed
EP-0801058-A1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents American Cyanamid Company (US) 1997-10-15 EP disclosed