SCHEMBL8536794

SCHEMBL8536794

C=CCSc1snnc1Cl

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
GAA P10253 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
SCHEMBL7581317 0.78 SMN1; SMN2 (0.34) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7081943 0.77 LMNA (0.36) ALDH1A1TP53ALOX15MEN1KMT2A
SCHEMBL7790910 0.77 ALDH1A1 (0.36) ALDH1A1MEN1KMT2A
SCHEMBL8536797 0.73 ALDH1A1 (0.36) ALDH1A1NPC1TP53HPGDALOX15
SCHEMBL8599818 0.69
SCHEMBL7594898 0.68 ALDH1A1 (0.36) ALDH1A1HPGDALOX15
SCHEMBL7677695 0.67 L3MBTL1 (0.42) ALDH1A1HPGDRAB9ASMN1; SMN2L3MBTL1
SCHEMBL29082169 0.67 ALDH1A1 (0.34) ALDH1A1HPGDALOX15
SCHEMBL11385336 0.65
SCHEMBL6431331 0.65 MEN1 (0.33) ALDH1A1TP53ALOX15SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1070486-C Fluorothiadiazolyloxyacetamide BAYER AG (DE) 2001-09-05 CN disclosed
CN-1288888-A Intermediates for the preparation of fluorothiadiazolyloxyacetamides BAYER AG (DE) 2001-03-28 CN disclosed
US-5858922-A SELECTIVE CONTROL OF WEEDS IN CROPS, ESPECIALLY PREEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1999-01-12 US disclosed
CN-1183777-A Fluorothiadiazolyloxyacetamide BAYER AG (DE) 1998-06-03 CN disclosed
EP-0815093-A1 HERBICIDE FLUOROTHIADIAZOLYL OXYACETAMIDES BAYER AG (DE) 1998-01-07 EP disclosed
WO-1996028434-A1 HERBICIDE FLUOROTHIADIAZOLYL OXYACETAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-09-19 WO disclosed