SCHEMBL21158801

SCHEMBL21158801

CCCCc1sccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
SLC6A3 Q01959 1/20 0.37
CTRC Q99895 1/20 0.34
PDE4A P27815 5/20 0.33
PDE4B Q07343 5/20 0.33
PDE4C Q08493 5/20 0.33
PDE4D Q08499 5/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
PDE3B Q13370 3/20 0.32
PDE3A Q14432 3/20 0.32
KCNH2 Q12809 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
HTR2A P28223 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
SCHEMBL27666384 0.94 HTR2A (0.38) CASP3SENP8SENP7SENP6SLC6A3
SCHEMBL19304385 0.92 HTR2A (0.41) SLC6A3MAPTKCNH2ALDH1A1KMT2A
SCHEMBL25547088 0.87
SCHEMBL27645263 0.83 THRB (0.37) GLASMN1; SMN2MAPTKCNH2ALDH1A1
SCHEMBL4584887 0.79 SLC6A3 (0.37) SLC6A3MAPTALDH1A1HTTKMT2A
SCHEMBL4550191 0.78
SCHEMBL3028441 0.78 MAOA (0.38) SLC6A3
SCHEMBL2096667 0.78 SLC6A3 (0.36) SLC6A3
SCHEMBL4457865 0.77 LTB4R (0.45) CTRCPDE4APDE4BPDE4CPDE4D
SCHEMBL8815622 0.77 ALOX5 (0.44) CASP3SENP8SENP7SENP6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200362097-A1 Chlorinated Benzodithiophene-based Polymers for Electronic and Photonic Applications THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-11-19 US disclosed
US-20200362097-A1 Chlorinated Benzodithiophene-based Polymers for Electronic and Photonic Applications THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-11-19 US disclosed
CN-111278888-A Chlorinated benzodithiophene-based polymers for photovoltaic applications 香港科技大学 2020-06-12 CN disclosed
WO-2019137329-A1 CHLORINATED BENZODITHIOPHENE-BASED POLYMERS FOR ELECTRONIC AND PHOTONIC APPLICATIONS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-07-18 WO disclosed
WO-2019137329-A1 CHLORINATED BENZODITHIOPHENE-BASED POLYMERS FOR ELECTRONIC AND PHOTONIC APPLICATIONS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-07-18 WO disclosed