SCHEMBL8097874

SCHEMBL8097874

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

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
PBRM1 Q86U86 4/20 0.40
NPC1 O15118 1/20 0.39
HPN P05981 1/20 0.39
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
HTR2C P28335 2/20 0.38
LMNA P02545 1/20 0.38
MAP1LC3B Q9GZQ8 1/20 0.37
HDAC4 P56524 1/20 0.36
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
CYP19A1 P11511 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
SCHEMBL8103216 0.81 ALDH1A1 (0.46) MAPTALDH1A1HPGDTSHRKMT2A
SCHEMBL8096856 0.81 TSHR (0.46) MAPTALDH1A1HPGDTSHRKMT2A
SCHEMBL8097793 0.81 ALDH1A1 (0.52) MAPTALDH1A1HPGDTSHRKMT2A
SCHEMBL8090390 0.81 ALDH1A1 (0.68) MAPTALDH1A1HPGDTSHRKMT2A
SCHEMBL8097532 0.81 ALDH1A1 (0.46) MAPTALDH1A1HPGDTSHRGAA
SCHEMBL8103668 0.81 MAPT (0.46) MAPTALDH1A1HPGDTSHRKMT2A
SCHEMBL8099374 0.78 ABCC9 (0.43) MAPTALDH1A1HPGDTSHRCYP19A1
SCHEMBL8098555 0.78 ALDH1A1 (0.43) MAPTALDH1A1HPGDTSHR
SCHEMBL8089737 0.78 PBRM1 (0.43) MAPTALDH1A1HPGDTSHRPBRM1
SCHEMBL8096825 0.77 TDP1 (0.48) MAPTALDH1A1HPGDTSHRKMT2A

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