SCHEMBL8964648

SCHEMBL8964648

Cc1nc(Cl)c(OC(=O)O)s1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
NTRK1 P04629 1/20 0.30
RECQL P46063 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
SCHEMBL8964833 0.85 POLB (0.33) PTGDR2ALDH1A1HPGDTSHRPOLB
SCHEMBL8965387 0.82 ALDH1A1 (0.42) ALDH1A1HPGDTSHRKMT2ALMNA
SCHEMBL486254 0.79 RAB9A (0.39) PTGDR2ALDH1A1HPGDTSHRRAB9A
SCHEMBL5237956 0.78 RAB9A (0.33) PTGDR2ALDH1A1HPGDTSHRRAB9A
SCHEMBL8965320 0.77 ALDH1A1 (0.32) ALDH1A1HPGDTSHR
SCHEMBL3252712 0.74 LMNA (0.38) PTGDR2ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL2428792 0.72 MAPT (0.47) ALDH1A1RAB9ASMN1; SMN2NPC1KDM4E
SCHEMBL2566875 0.72 KMT2A (0.32) PTGDR2RAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL8964642 0.71 ALDH1A1 (0.53) PTGDR2ALDH1A1HPGDTSHRRAB9A
SCHEMBL9197831 0.69 ALDH1A1 (0.47) ALDH1A1HPGDTSHRRAB9ASMN1; SMN2

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-0459244-B1 Sulphonilised carboxylic acid amides BAYER AG (DE) 1996-02-28 EP disclosed
EP-0569810-A1 Sulphonylamide herbicides BAYER AG (DE) 1993-11-18 EP disclosed
EP-0459244-A1 Sulphonilised carboxylic acid amides BAYER AG (DE) 1991-12-04 EP disclosed