SCHEMBL21578629

SCHEMBL21578629

CC1(C)c2ccccc2Sc2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3N4c3cccc(-c4ccccc4)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSP90AA1 P07900 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
MGLL Q99685 1/20 0.36
DRD2 P14416 2/20 0.34
ADAMTS5 Q9UNA0 1/20 0.32
BCHE P06276 1/20 0.31
COMT P21964 1/20 0.30
HSD11B1 P28845 1/20 0.30
NR1H2 P55055 1/20 0.30
PGR P06401 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
SCHEMBL13557561 0.93 DRD2 (0.34) DRD2ADAMTS5BCHE
SCHEMBL13557545 0.93 DRD2 (0.35) FAAHMGLLDRD2ADAMTS5BCHE
SCHEMBL13557542 0.93 PGR (0.33) DRD2ADAMTS5PGR
SCHEMBL13557560 0.89 DRD2 (0.36) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL13557631 0.89 ALDH1A1 (0.44) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL21578632 0.89 HDAC6 (0.35) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL21578526 0.86 FAAH (0.42) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL20230628 0.86 ADAMTS5 (0.33) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL13231464 0.86 HTT (0.41) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL20230579 0.84 ADAMTS5 (0.33) ALDH1A1ADAMTS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978642-B2 Mixture, composition and organic electronic device GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2021-04-13 US disclosed
EP-3553152-B1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MAT LTD (CN) 2021-02-17 EP disclosed
US-20200098992-A1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2020-03-26 US disclosed
US-20190355911-A1 ORGANIC MIXTURE, ORGANIC COMPOSITION, ORGANIC ELECTRONIC COMPONENT AND PREPARATION METHOD THEREFOR GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-11-21 US disclosed