SCHEMBL7106224

SCHEMBL7106224

COc1cccc(-c2sc3cc(OC)ccc3c2Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
ALDH1A1 P00352 4/20 0.55
HSD17B10 Q99714 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
PRNP P04156 1/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
PPARG P37231 1/20 0.52
MAPK10 P53779 1/20 0.52
NCOA2 Q15596 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL7107730 0.88 ITGA4 (0.53) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7936769 0.86 MAPT (0.59) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7107022 0.82 L3MBTL1 (0.49) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7936791 0.81 PRNP (0.55) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7103621 0.81 MAPT (0.51) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7102544 0.77 MAPT (0.53) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7102538 0.76 ESR1 (0.57) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7945788 0.75 ESR1 (0.53) MAPTALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL7106140 0.75 RAPGEF4 (0.44) MAPTALDH1A1CYP3A4CYP2C19HTT
SCHEMBL24703043 0.74 MAPT (0.47) MAPTALDH1A1HSD17B10CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0827959-B1 Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods LILLY CO ELI (US) 2003-12-03 EP disclosed
US-5977382-A Benzo[b]thiophene compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 1999-11-02 US disclosed
US-5977098-A Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 1999-11-02 US disclosed
US-5952513-A TREATING POSTMENOPAUSAL SYNDROME SUCH AS OSTEOPOROSIS ELI LILLY AND COMPANY (US) 1999-09-14 US disclosed
US-5843965-A Benzo B! thiophene compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 1998-12-01 US disclosed
EP-0827959-A2 Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 1998-03-11 EP disclosed