SCHEMBL3797934

SCHEMBL3797934

CCC(C)c1cccc2sccc12

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
ALOX5 P09917 1/20 0.35
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
CYP19A1 P11511 1/20 0.33
TBXAS1 P24557 1/20 0.33
SYK P43405 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAPT P10636 1/20 0.33
GPR139 Q6DWJ6 2/20 0.32
SELPLG Q14242 1/20 0.32
RORC P51449 1/20 0.31

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
SCHEMBL21504976 0.81 ALOX5 (0.33) ALOX5ADRA2AADRA2BCYP19A1TBXAS1
SCHEMBL29945210 0.81 GABRA1 (0.41) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL826728 0.81 GABRA1 (0.41) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL29985513 0.78 CYP1A2 (0.41) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL19682339 0.78 P2RX7 (0.36) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL16844603 0.78 ADRA2A (0.39) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL20509484 0.78 CYP1A2 (0.41) TSHRALOX5ADRA2AADRA2BCYP19A1
SCHEMBL8502975 0.76 ALOX5 (0.49) TSHRALOX5SLC6A2SLC6A4SLC6A3
SCHEMBL16844606 0.75 ADRA2A (0.33) ALOX5ADRA2AADRA2BCYP19A1TBXAS1
SCHEMBL4447936 0.74 ALOX5 (0.34) ALOX5ADRA2AADRA2BCYP19A1TBXAS1

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-3371170-B1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES HOFFMANN LA ROCHE (CH) 2019-07-31 EP disclosed
US-7989137-B2 Resist composition and pattern-forming method using the same FUJIFILM CORPORATION (JP) 2011-08-02 US disclosed
US-7645400-B2 Composition containing carbon nanotubes having a coating MITSUBISHI RAYON CO., LTD. (JP) 2010-01-12 US disclosed
US-20090321688-A1 Carbon Nanotube Composition, Composite Having a Coated Film Composed of the Same, and Their Production Methods MITSUBISHI RAYON CO., LTD. (JP) 2009-12-31 US disclosed
US-20090087789-A1 RESIST COMPOSITION AND PATTERN-FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20060052509-A1 Composition containing carbon nanotubes having coating thereof and process for producing them MITSUBISHI RAYON CO., LTD. (JP) 2006-03-09 US disclosed