SCHEMBL10725852

SCHEMBL10725852

COc1cc2ccsc2c(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.39
PDGFRA P16234 2/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 4/20 0.37
KEAP1 Q14145 1/20 0.35
G6PD P11413 1/20 0.34
KDM4E B2RXH2 2/20 0.33
RPS6KB2 Q9UBS0 1/20 0.33
GAA P10253 1/20 0.33
NPC1 O15118 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PDE10A Q9Y233 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33

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
SCHEMBL19756640 0.79 ALDH1A1 (0.42) PDGFRBPDGFRAMAPTTSHRALDH1A1
SCHEMBL14673728 0.79 MAPT (0.41) PDGFRBPDGFRAMAPTTSHRALDH1A1
SCHEMBL16009860 0.76 MAOA (0.42) MAPTTSHRALDH1A1KEAP1KDM4E
SCHEMBL11310484 0.73 MAPT (0.44) MAPTTSHRALDH1A1KDM4ENPC1
SCHEMBL10726158 0.73 CYP2C9 (0.47) MAPTTSHRALDH1A1KDM4E
SCHEMBL10368828 0.72 CA12 (0.42) MAPTTSHRALDH1A1KDM4ECA2
SCHEMBL4803345 0.72 MAPT (0.40) PDGFRBPDGFRAMAPTTSHRALDH1A1
SCHEMBL15018567 0.72 ACHE (0.43) PDGFRBPDGFRAMAPTTSHRALDH1A1
SCHEMBL11009295 0.71 SMN1; SMN2 (0.42) ALDH1A1GAASMN1; SMN2
SCHEMBL10729810 0.71 HPGD (0.38) TSHRALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4672138-A INTERMEDIATES FOR BENZO (B) THIOPHENES; HYPOTENSIVE AGENTS, DIURETICS HOECHST ROUSSEL PHARMACEUTICALS INC. (US) 1987-06-09 US disclosed
EP-0050326-B1 BENZO(B)THIOPHENES HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-01-29 EP disclosed
EP-0155981-A2 Derivatives of alkoxythiophenol; alkoxyphenolthio carbamates HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1985-10-02 EP disclosed
US-4537976-A Benzo[b]thiophenes HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-08-27 US disclosed
US-4528399-A Benzo[b]thiophenes intermediates HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-07-09 US disclosed
US-4436748-A HYPOTENSIVES, DIURETICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1984-03-13 US disclosed
EP-0050326-A2 Benzo(b)thiophenes HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1982-04-28 EP disclosed