SCHEMBL8556147

SCHEMBL8556147

COc1cc(Cl)ccc1-c1oc(Cc2ccccc2)nc1-c1ccccc1S(N)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
PTGES2 Q9H7Z7 10/20 0.42
RXRA P19793 2/20 0.40
KAT6A Q92794 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SCN9A Q15858 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
P2RX3 P56373 1/20 0.35
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
RXRB P28702 1/20 0.35

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
SCHEMBL8560882 0.96 MAPT (0.43) MAPTPTGES2RXRAKAT6AALDH1A1
SCHEMBL8559042 0.90 L3MBTL1 (0.43) MAPTRXRAALDH1A1CA12CA1
SCHEMBL8559802 0.89 RXRA (0.49) MAPTPTGES2RXRAALDH1A1SCN9A
SCHEMBL8554229 0.89 CDK9 (0.42) RXRACA12CA1CA2CA9
SCHEMBL8553816 0.87 MAPT (0.40) MAPTRXRAALDH1A1LMNAP2RX3
SCHEMBL8561449 0.87 RXRA (0.40) MAPTPTGES2RXRAALDH1A1LMNA
SCHEMBL7499023 0.86 CA2 (0.43) MAPTRXRAALDH1A1LMNACA12
SCHEMBL8557664 0.86 L3MBTL1 (0.43) MAPTRXRAALDH1A1CA12CA1
SCHEMBL8553420 0.85 MAPT (0.40) MAPTRXRAALDH1A1LMNACA12
SCHEMBL8556401 0.85 CYP2C9 (0.40) MAPTPTGES2RXRAALDH1A1LMNA

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
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed