SCHEMBL8097793

SCHEMBL8097793

Cc1cccc(C2NC(=O)C(Cl)S2)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MAPT P10636 2/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
PBRM1 Q86U86 4/20 0.42
NPC1 O15118 1/20 0.39
HPN P05981 1/20 0.39
HTR2C P28335 2/20 0.38
GAA P10253 2/20 0.36
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
CYP19A1 P11511 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34

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
SCHEMBL8097874 0.81 MAPT (0.49) ALDH1A1MAPTHPGDTSHRKMT2A
SCHEMBL8089623 0.81 ALDH1A1 (0.49) ALDH1A1MAPTHPGDTSHRGAA
SCHEMBL8090455 0.81 ALDH1A1 (0.49) ALDH1A1MAPTHPGDTSHRKMT2A
SCHEMBL8089861 0.81 ALDH1A1 (0.49) ALDH1A1MAPTHPGDTSHRKMT2A
SCHEMBL8103622 0.78 ALDH1A1 (0.46) ALDH1A1MAPTHPGDTSHRCYP19A1
SCHEMBL9389991 0.72 ALDH1A1 (0.40) ALDH1A1MAPTHPGDTSHRCYP19A1
SCHEMBL8089821 0.70 GFER (0.56) KMT2AMEN1PBRM1NPC1HPN
SCHEMBL8097598 0.69 ALDH1A1 (0.38) ALDH1A1MAPTHPGDTSHRKMT2A
SCHEMBL6381813 0.66 TDP1 (0.50) ALDH1A1MAPTKMT2AMEN1PBRM1
SCHEMBL8922119 0.66 TDP1 (0.50) ALDH1A1MAPTKMT2AMEN1PBRM1

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