SCHEMBL7435945

SCHEMBL7435945

COc1ccc(-c2csc(C(=N)NO)n2)c(Cl)c1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 3/20 0.38
THRB P10828 2/20 0.38
AMY1A P0DUB6 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
PLAU P00749 3/20 0.35
VCP P55072 1/20 0.33
ALOX5 P09917 1/20 0.33
C1S P09871 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33

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
SCHEMBL7436833 0.80 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL7435953 0.78 ALDH1A1 (0.42) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL7436144 0.77 THRB (0.40) ALDH1A1MAPTTHRBMEN1POLB
SCHEMBL434333 0.76 MEN1 (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTTHRB
SCHEMBL7431101 0.76 HTR2C (0.52) KDM4ESMN1; SMN2LMNATHRBMEN1
SCHEMBL7434486 0.73 ATP4A (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL7444059 0.72 MAPT (0.40) ALDH1A1MAPTTHRBCYP1A1CYP1B1
SCHEMBL7434680 0.72 GAA (0.62) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL7435763 0.71 MAPT (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTMEN1
SCHEMBL7440810 0.71 POLB (0.39) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT

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-0506194-B1 4-aryl-thiazole or imidazole derivatives AKZO NOBEL NV (NL) 1996-08-21 EP disclosed
US-5462959-A 4-aryl-imidazole derivatives AKZO N.V. (NL) 1995-10-31 US disclosed
US-5254575-A 4-aryl-thiazole derivatives AKZO N.V. (NL) 1993-10-19 US disclosed
EP-0506194-A1 4-aryl-thiazole or imidazole derivatives Akzo Nobel N.V. (NL) 1992-09-30 EP disclosed