SCHEMBL9754147

SCHEMBL9754147

COc1ccc2cc(C(C)c3sc(-c4ccsc4)nc3O)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COPS5 Q92905 1/20 0.47
NPC1 O15118 1/20 0.46
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43
PDGFRB P09619 2/20 0.43
PDGFRA P16234 2/20 0.43
ABCB11 O95342 1/20 0.40
PTGS2 P35354 3/20 0.40
AKR1C3 P42330 3/20 0.40
AKR1C2 P52895 3/20 0.40
PTGS1 P23219 2/20 0.40
TSHR P16473 2/20 0.40
CDC42 P60953 1/20 0.40
RAC1 P63000 1/20 0.40
CYP1A2 P05177 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
MAOB P27338 2/20 0.38
MAOA P21397 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL9754168 0.86 COPS5 (0.49) COPS5CDC7DBF4ABCB11PTGS2
SCHEMBL9754206 0.85 ALOX5 (0.53) COPS5NPC1ABCB11PTGS2AKR1C3
Potassium SCHEMBL9754024 0.84 ALOX5 (0.52) COPS5NPC1ABCB11PTGS2AKR1C3
SCHEMBL9754018 0.84 ALOX5 (0.52) COPS5NPC1ABCB11PTGS2AKR1C3
SCHEMBL9754414 0.80 COPS5 (0.47) COPS5ABCB11PTGS2AKR1C3AKR1C2
SCHEMBL9754287 0.77 COPS5 (0.47) COPS5NPC1ABCB11PTGS2AKR1C3
SCHEMBL9803509 0.77 SMN1; SMN2 (0.49) COPS5NPC1TSHRCYP1A2LMNA
SCHEMBL9803892 0.77 COPS5 (0.44) COPS5ABCB11PTGS2AKR1C3AKR1C2
SCHEMBL9803898 0.76 COPS5 (0.46) COPS5PDGFRBPDGFRAABCB11PTGS2
SCHEMBL9754184 0.70 COPS5 (0.47) COPS5ABCB11PTGS2AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991008744-A1 THIAZOLE LIPOXYGENASE-INHIBITING COMPOUNDS DERIVED FROM NON-STEROIDAL ANTIINFLAMMATORY CARBOXYLIC ACIDS ABBOTT LABORATORIES (US) 1991-06-27 WO claimed
US-5032588-A Non-steroidal antiinflammatory ABBOTT LABORATORIES (US) 1991-07-16 US disclosed
WO-1991008744-A1 THIAZOLE LIPOXYGENASE-INHIBITING COMPOUNDS DERIVED FROM NON-STEROIDAL ANTIINFLAMMATORY CARBOXYLIC ACIDS ABBOTT LABORATORIES (US) 1991-06-27 WO disclosed