SCHEMBL8722252

SCHEMBL8722252

O=C(Nc1ccccc1)c1csc(Oc2cccc(Cl)c2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
LMNA P02545 4/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
ALDH1A1 P00352 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
KMT2A Q03164 3/20 0.59
ATM Q13315 2/20 0.59
NPSR1 Q6W5P4 2/20 0.59
MEN1 O00255 2/20 0.59
KDM4E B2RXH2 1/20 0.59
GAA P10253 1/20 0.59
HPGD P15428 1/20 0.59
PIN1 Q13526 1/20 0.52
TDP1 Q9NUW8 2/20 0.51
CNR2 P34972 1/20 0.50
NPY1R P25929 1/20 0.50
NPY2R P49146 1/20 0.50
GALR3 O60755 1/20 0.49
GRM4 Q14833 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49

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
SCHEMBL8726514 0.85 PTGER2 (0.46) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL9236648 0.81 ICAM1 (0.46) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8724307 0.76 L3MBTL1 (0.57) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL21066417 0.73 MAPT (0.67) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL21130396 0.72 MAPT (0.67) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL5343234 0.72 KDM4E (0.45) LMNAL3MBTL1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL10971064 0.71 ALDH1A1 (0.72) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL27874895 0.69 NPC1 (0.73) MAPTLMNAALDH1A1SMN1; SMN2KMT2A
SCHEMBL14014056 0.69 TDP1 (0.66) MAPTLMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL19914352 0.69 TDP1 (0.66) MAPTLMNAL3MBTL1ALDH1A1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700394-B1 HERBICIDAL THIAZOLE DERIVATIVES SHELL INT RESEARCH (NL) 1998-04-01 EP disclosed
US-5693594-A Herbicidal thiazole derivatives AMERICAN CYANAMID COMPANY (US) 1997-12-02 US disclosed
EP-0700394-A1 HERBICIDAL THIAZOLE DERIVATIVES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1996-03-13 EP disclosed
WO-1994027983-A1 HERBICIDAL THIAZOLE DERIVATIVES SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1994-12-08 WO disclosed