SCHEMBL24640702

SCHEMBL24640702

CC(C)N1CCN2c3ncccc3OCC[C@@H]2C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 3/20 0.41
HRH3 Q9Y5N1 5/20 0.38
OGA O60502 2/20 0.34
HTR6 P50406 3/20 0.34
HTR2A P28223 4/20 0.33
HTR2C P28335 4/20 0.33
HTR2B P41595 4/20 0.33
PIK3CD O00329 1/20 0.32
PDE10A Q9Y233 1/20 0.32
ICMT O60725 1/20 0.32

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
SCHEMBL24640038 1.00 SOS1 (0.41) SOS1HRH3OGAHTR6HTR2A
SCHEMBL24640703 1.00 SOS1 (0.41) SOS1HRH3OGAHTR6HTR2A
SCHEMBL24763762 0.89 SOS1 (0.35) SOS1HRH3OGAHTR6ICMT
SCHEMBL24640808 0.88 LTA4H (0.37) SOS1HRH3OGAHTR6HTR2A
SCHEMBL24640717 0.88 LTA4H (0.37) SOS1HRH3OGAHTR6HTR2A
SCHEMBL24640006 0.84 HTR2A (0.43) SOS1HTR6HTR2AHTR2CHTR2B
SCHEMBL24640004 0.84 HTR2A (0.43) SOS1HTR6HTR2AHTR2CHTR2B
SCHEMBL24640008 0.84 HTR2A (0.43) SOS1HTR6HTR2AHTR2CHTR2B
SCHEMBL2016209 0.80 SOS1 (0.46) SOS1HRH3
SCHEMBL24639353 0.80 SOS1 (0.41) SOS1PIK3CD

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
WO-2022170974-A1 TRICYCLIC DERIVATIVES USEFUL AS PARP7 INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-08-18 WO disclosed