SCHEMBL30726019

SCHEMBL30726019

CN(C)CCCN(CCSc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
POLB P06746 1/20 0.44
BCL2 P10415 1/20 0.42
DRD2 P14416 2/20 0.40
DRD4 P21917 2/20 0.40
SERPINE1 P05121 1/20 0.40
FDPS P14324 1/20 0.38
SLC6A4 P31645 2/20 0.38
HTR7 P34969 2/20 0.37
HTR1A P08908 1/20 0.37
GAA P10253 1/20 0.37
DRD3 P35462 1/20 0.36
MAPT P10636 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL11675550 0.82 MAPT (0.49) RAB9APOLBDRD2DRD4GAA
SCHEMBL14566171 0.78 RAB9A (0.59) RAB9APOLBSERPINE1FDPSSLC6A4
SCHEMBL17346018 0.78 ALDH1A1 (0.44) POLBSERPINE1FDPSHTR7HTR1A
SCHEMBL11677475 0.76 ALDH1A1 (0.45) POLBFDPSGAAMAPT
SCHEMBL11732280 0.74 MAPT (0.47) RAB9APOLBGAAMAPT
SCHEMBL17345919 0.74 HTR2A (0.41) HTR7
SCHEMBL30119783 0.74 RAB9A (0.53) RAB9APOLBSERPINE1MAPT
SCHEMBL17346323 0.72 SIGMAR1 (0.44) POLB
SCHEMBL17346333 0.72 FDPS (0.52) SERPINE1FDPSSLC6A4HTR7HTR1A
SCHEMBL11317229 0.72 CNR2 (0.47) POLBGAAMAPT

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
CN-117423791-A Chip structure and manufacturing method thereof 京东方科技集团股份有限公司 2024-01-19 CN disclosed