SCHEMBL23969743

SCHEMBL23969743

CCC1C=CC(c2ccccc2F)=CC1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.31
HTR1A P08908 2/20 0.31
HTR7 P34969 2/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 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
SCHEMBL23969704 0.78 ESR2 (0.34)
SCHEMBL19393956 0.74 RARB (0.36)
SCHEMBL7991916 0.72
SCHEMBL16361099 0.68 SMN1; SMN2 (0.33) KDM4EALDH1A1MAPT
SCHEMBL8640782 0.66
SCHEMBL15037756 0.66
SCHEMBL28295106 0.65 NISCH (0.35) ADORA2ANPSR1KDM4EALDH1A1MAPT
SCHEMBL18725034 0.64
SCHEMBL28010316 0.64 ADORA2A (0.32) ADORA2AADORA1
SCHEMBL12318078 0.63

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-3904366-A1 END CAPPED NUCLEIC ACID MOLECULES Novartis AG (CH) 2021-11-03 EP disclosed