SCHEMBL9603073

SCHEMBL9603073

COc1c(C(C)=O)sc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.59
KMT2A Q03164 5/20 0.59
F2 P00734 1/20 0.59
LMNA P02545 3/20 0.53
MAPK1 P28482 2/20 0.53
ALDH1A1 P00352 4/20 0.51
GAA P10253 2/20 0.51
MEN1 O00255 2/20 0.51
ATM Q13315 2/20 0.51
HPGD P15428 2/20 0.51
KDM4E B2RXH2 2/20 0.51
GLA P06280 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAOB P27338 1/20 0.50
ALOX5 P09917 1/20 0.49
F10 P00742 1/20 0.47
SENP5 Q96HI0 1/20 0.47
SENP2 Q9HC62 1/20 0.47
SENP1 Q9P0U3 1/20 0.47

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
SCHEMBL1098130 0.86 MCL1 (0.57) MAPTKMT2AF2LMNAMAPK1
SCHEMBL6596229 0.85 LMNA (0.51) MAPTKMT2AF2LMNAMAPK1
SCHEMBL5453335 0.85 LIMK1 (0.60) MAPTKMT2AF2LMNAMAPK1
SCHEMBL9025214 0.85 LMNA (0.69) MAPTKMT2AF2LMNAMAPK1
SCHEMBL29445497 0.82 HDAC1 (0.60) MAPTKMT2ALMNAMAPK1ALDH1A1
SCHEMBL18957793 0.80 ESR1 (0.46) MAPTKMT2AF2MAPK1ALDH1A1
SCHEMBL4604056 0.80 PTPN1 (0.60) MAPTKMT2AF2LMNAMAPK1
SCHEMBL9024182 0.79 SENP5 (0.58) MAPTKMT2ALMNAMAPK1ALDH1A1
SCHEMBL10747184 0.79 LMNA (0.46) MAPTKMT2AF2LMNAMAPK1
SCHEMBL11084707 0.77 LMNA (0.44) MAPTKMT2AF2LMNAMAPK1

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
EP-0279263-B1 INDOLE, BENZOFURAN, BENZOTHIOPHENE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1993-08-04 EP disclosed
US-4873259-A Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-10-10 US disclosed
EP-0279263-A2 Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1988-08-24 EP disclosed