SCHEMBL6790443

SCHEMBL6790443

O=C(Oc1c(F)c(F)c(F)c(F)c1F)[C@@H]1CCCN1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.38
HTR2A P28223 2/20 0.38
SCN4A P35499 1/20 0.37
NOS2 P35228 2/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
PRCP P42785 1/20 0.36
DPP4 P27487 4/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
DPP8 Q6V1X1 2/20 0.34
DPP9 Q86TI2 2/20 0.34
HTR2B P41595 2/20 0.34
FAP Q12884 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
ELANE P08246 1/20 0.33

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
SCHEMBL6802754 1.00 HTR2C (0.38) HTR2CHTR2ASCN4ANOS2NOS3
SCHEMBL8305414 1.00 HTR2C (0.38) HTR2CHTR2ASCN4ANOS2NOS3
SCHEMBL29017890 0.79 MEN1 (0.35) HTR2CHTR2APRCPHTR2B
SCHEMBL20400865 0.74 NOS2 (0.33) HTR2CHTR2ASCN4ANOS2NOS3
SCHEMBL10241519 0.74 SCN4A (0.43) SCN4ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL2677256 0.74 SCN4A (0.43) SCN4ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL23679866 0.74
SCHEMBL51793 0.74
SCHEMBL118100 0.74
SCHEMBL7611373 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894608-A Methionine synthesized collagen polypeptide, tripeptide monomer molecule and preparation method thereof 杭州协合医疗用品有限公司 2023-04-04 CN disclosed
US-6713603-B2 ADJUSTED NUCLEOTIDE SEQUENCES FOR USE AS ANTISENSE TOOLS IN GENETIC ENGINEERING ISIS INNOVATION LIMITED (GB) 2004-03-30 US disclosed
US-6403763-B1 Chiral peptide nucleic acids ISIS INNOVATION LIMITED (GB) 2002-06-11 US disclosed
EP-0956297-A1 CHIRAL PEPTIDE NUCLEIC ACIDS ISIS INNOVATION LIMITED (GB) 1999-11-17 EP disclosed
WO-1998016550-A1 CHIRAL PEPTIDE NUCLEIC ACIDS ISIS INNOVATION LIMITED (GB) 1998-04-23 WO disclosed