SCHEMBL28248372

SCHEMBL28248372

N#Cc1cccc(CCCc2cccc(C#N)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.54
GLA P06280 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP19A1 P11511 1/20 0.47
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
CNR1 P21554 1/20 0.46
KCNJ1 P48048 1/20 0.46
KCNH2 Q12809 1/20 0.46
FFAR1 O14842 2/20 0.45
FFAR4 Q5NUL3 1/20 0.45
FOLH1 Q04609 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45
MEP1A Q16819 1/20 0.45
MEP1B Q16820 1/20 0.45
SCN8A Q9UQD0 1/20 0.44
ENPP2 Q13822 1/20 0.44
NOS1 P29475 1/20 0.43

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
SCHEMBL28865565 0.96 HTR2B (0.50) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL24358855 0.94 HTR2B (0.49) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL29732423 0.94 HTR2B (0.49) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL2154019 0.91 GLA (0.53) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL6962952 0.90 DRD2 (0.49) HTR2BGLAKCNJ1KCNH2FFAR1
SCHEMBL5545471 0.88 HTR2B (0.46) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL6951637 0.88 FAAH (0.50) HTR2BGLAKCNJ1KCNH2FFAR1
SCHEMBL6960752 0.88 FAAH (0.50) HTR2BGLAKCNJ1KCNH2FFAR1
SCHEMBL80726 0.88 HTR2B (0.46) HTR2BGLAMEN1KMT2ACYP19A1
SCHEMBL30429240 0.88 MRGPRX4 (0.48) HTR2BGLAMEN1KMT2ACYP19A1

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-106083927-B Phosphino- amidine compound, metal complex, antigravity system and their oligomeric or olefin polymerization purposes 切弗朗菲利浦化学公司 2018-10-26 CN disclosed