SCHEMBL23739435

SCHEMBL23739435

CCCn1c2cc(C)ccc2c2ccc(C)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.43
HPGD P15428 2/20 0.41
TLR8 Q9NR97 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
PGR P06401 1/20 0.41
RORA P35398 1/20 0.41
RORC P51449 1/20 0.41
RORB Q92753 1/20 0.41
CNR2 P34972 3/20 0.39
ADORA2A P29274 3/20 0.38
ADORA2B P29275 3/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38

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
SCHEMBL18947670 0.88 RORA (0.53) DYRK1ATLR8ALDH1A1KDM4EPGR
SCHEMBL19073061 0.88 PSEN1 (0.41) DYRK1AHPGDTLR8ALDH1A1MAPT
SCHEMBL12593197 0.86 TLR8 (0.56) TLR8PGRRORARORCRORB
SCHEMBL12593201 0.85 TLR8 (0.55) TLR8PGRRORARORCRORB
SCHEMBL12593198 0.85 TLR8 (0.55) TLR8PGRRORARORCRORB
SCHEMBL13304767 0.83 RORA (0.55) HPGDTLR8ALDH1A1MAPTKDM4E
SCHEMBL12548590 0.83 KDM4E (0.43) DYRK1AHPGDTLR8ALDH1A1MAPT
SCHEMBL31609261 0.82 TLR8 (0.34) TLR8ALDH1A1MAPTKDM4ELMNA
SCHEMBL15458667 0.80 HPGD (0.61) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL17704935 0.79 RORA (0.46) DYRK1ATLR8ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397637-B1 COMPOUND FOR PHOTOACTIVE ORGANIC ELECTRONIC ELEMENT, AND PHOTOACTIVE ORGANIC ELECTRONIC ELEMENT COMPRISING THE COMPOUND HELIATEK GMBH (DE) 2021-08-11 EP disclosed