SCHEMBL16356252

SCHEMBL16356252

CCCCC(CC)CN1C(=O)c2c(C)sc(C)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 1/20 0.42
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 2/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP3A4 P08684 5/20 0.34
TSHR P16473 4/20 0.34

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
SCHEMBL16604924 0.89 LMNA (0.34) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL16307284 0.88 LMNA (0.35) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL16307283 0.88 LMNA (0.35) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL16604934 0.88 LMNA (0.35) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL19421857 0.87 ALDH1A1 (0.41) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL1037798 0.83 ALDH1A1 (0.41) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL1498216 0.80 ALDH1A1 (0.39) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL12832021 0.80 ALDH1A1 (0.39) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL17622373 0.79 ALDH1A1 (0.40) ALDH1A1KDM4ETHRBHPGDKMT2A
SCHEMBL5335314 0.79 ALDH1A1 (0.40) ALDH1A1KDM4ETHRBHPGDKMT2A

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-20210139643-A1 POLYMER COMPOUND AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-05-13 US disclosed
US-9412950-B2 Polymer compound and organic photoelectric conversion device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-09 US disclosed
US-9249257-B2 Copolymer, organic semiconductor material, organic electrical device, photovoltaic module MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-9212254-B2 2015-12-15 US disclosed
EP-2857429-A1 COPOLYMER, ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC ELECTRICAL DEVICE, AND SOLAR CELL MODULE Mitsubishi Chemical Corporation (JP) 2015-04-08 EP disclosed
US-20150094436-A1 COPOLYMER, ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC ELECTRICAL DEVICE, AND PHOTOVOLTAIC MODULE MITSUBISHI CHEMICAL CORPORATION (JP) 2015-04-02 US disclosed
US-20140373912-A1 POLYMER COMPOUND AND ORGANIC PHOTOELECTRIC CONVERSION DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-12-25 US disclosed