SCHEMBL8323119

SCHEMBL8323119

O=C(O)c1sc2cc(CBr)ccc2c1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.66
BCL2L1 Q07817 1/20 0.66
BCKDK O14874 2/20 0.65
RXFP1 Q9HBX9 2/20 0.65
TBXAS1 P24557 1/20 0.58
MAPT P10636 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
DYRK1A Q13627 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PRNP P04156 1/20 0.43
TSHR P16473 1/20 0.43
PPARG P37231 1/20 0.43
HTT P42858 1/20 0.43
MAPK10 P53779 1/20 0.43

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
SCHEMBL13819863 0.85 MCL1 (0.70) MCL1BCL2L1BCKDKRXFP1TBXAS1
SCHEMBL2431312 0.83 MAPT (0.52) MCL1BCL2L1BCKDKRXFP1TBXAS1
SCHEMBL31207832 0.82 TBXAS1 (0.58) MCL1BCL2L1BCKDKRXFP1TBXAS1
SCHEMBL8020988 0.81 CYP4F2 (0.54) MCL1BCL2L1BCKDKRXFP1MAPT
SCHEMBL417349 0.80 MCL1 (1.00) MCL1BCL2L1BCKDKRXFP1TBXAS1
SCHEMBL18050231 0.80 MCL1 (0.71) MCL1BCL2L1BCKDKRXFP1TBXAS1
SCHEMBL6886010 0.79 MCL1 (1.00) MCL1BCL2L1BCKDKRXFP1TBXAS1
Hydrochloric Acid SCHEMBL10855356 0.78 MCL1 (0.69) MCL1BCL2L1BCKDKRXFP1TBXAS1
Hydrochloric Acid SCHEMBL11398368 0.78 MCL1 (0.97) MCL1BCL2L1BCKDKRXFP1TBXAS1
Hydrochloric Acid SCHEMBL11394582 0.78 MCL1 (0.97) MCL1BCL2L1BCKDKRXFP1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0921124-A1 Benzothiophene derivatives useful in therapy Pfizer Limited (GB) 1999-06-09 EP disclosed