SCHEMBL8103926

SCHEMBL8103926

Cc1ccc(N2CSC(O)C2=O)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PKM P14618 1/20 0.43
MAPT P10636 5/20 0.43
POLB P06746 2/20 0.43
GAA P10253 2/20 0.43
RECQL P46063 1/20 0.43
GFER P55789 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL8089747 0.87 SLC6A2 (0.45) MAPTKMT2AMEN1SLC6A2SLC6A4
SCHEMBL8099358 0.84 ALDH1A1 (0.46) ALDH1A1HPGDSMN1; SMN2PKMMAPT
SCHEMBL8090534 0.83 KAT2B (0.48) ALDH1A1HPGDMAPTPOLBGAA
SCHEMBL8098980 0.80
SCHEMBL8089969 0.80 NOTUM (0.38) SMN1; SMN2MAPTPOLBL3MBTL1KMT2A
SCHEMBL8097872 0.79 HTT (0.42) ALDH1A1HPGDSMN1; SMN2PKMPOLB
SCHEMBL8097620 0.79 HSD17B10 (0.39) ALDH1A1HPGDPOLBLMNA
SCHEMBL8090389 0.78 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2MAPTGAAGFER
SCHEMBL8098716 0.77 NOTUM (0.45)
SCHEMBL8090023 0.77 ALDH1A1 (0.33) ALDH1A1MAPTGAAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672038-B1 HERBICIDES ZENECA LTD (GB) 2000-01-19 EP disclosed
US-5856273-A CONTROLLING WEEDS ZENECA LIMITED (GB) 1999-01-05 US disclosed
EP-0672038-A1 HERBICIDES ZENECA LIMITED (GB) 1995-09-20 EP disclosed
WO-1994013652-A1 HERBICIDES ZENECA LIMITED (GB) 1994-06-23 WO disclosed