SCHEMBL9508130

SCHEMBL9508130

Cc1cc2sc3cc(C)c(F)cc3c2cc1F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ILK Q13418 2/20 0.35
GAA P10253 1/20 0.32
GPR3 P46089 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25583309 0.86 BCL2L1 (0.39) GAAALDH1A1SMN1; SMN2
SCHEMBL10031356 0.86 ILK (0.33) ILKGAATP53
SCHEMBL13671890 0.86 GAA (0.34) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL20342390 0.81 ILK (0.31) ILK
SCHEMBL11976505 0.78 GAA (0.42) GAAGPR3ALDH1A1TP53CYP3A4
SCHEMBL17899833 0.78 MIF (0.33) GPR3ALDH1A1SMN1; SMN2
SCHEMBL752709 0.76 MIF (0.32) ALDH1A1
SCHEMBL10031380 0.73 TP53 (0.31) TP53
SCHEMBL31670142 0.72 GRM6 (0.36) ILKGAAALDH1A1
SCHEMBL6840187 0.72 MCL1 (0.60) GAATSHR

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
EP-1344788-B1 Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs SUMITOMO CHEMICAL CO (JP) 2010-06-23 EP disclosed
EP-2107076-A1 Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs Sumitomo Chemical Company, Limited (JP) 2009-10-07 EP disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 US disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 US disclosed
EP-0399293-B1 PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE BAYER AG (DE) 1993-09-01 EP disclosed
US-5095157-A Friedel-crafts catalyst BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed
EP-0399293-A1 Process for preparing 2-chloro-4-nitro-alkylbenzene BAYER AG (DE) 1990-11-28 EP disclosed