SCHEMBL20198484

SCHEMBL20198484

Cc1cnn(CCOI)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 5/20 0.36
KMT2A Q03164 2/20 0.36
ALPI P09923 1/20 0.36
ALPG P10696 1/20 0.36
PLAA Q9Y263 1/20 0.36
CYP3A4 P08684 2/20 0.34
CYP2C19 P33261 2/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NOS1 P29475 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2C9 P11712 1/20 0.32
KLKB1 P03952 2/20 0.30
KLK1 P06870 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
SCHEMBL12017393 0.82 LMNA (0.39) LMNAHTTSMN1; SMN2GAAKMT2A
SCHEMBL18963615 0.79
SCHEMBL6936934 0.79 LMNA (0.40) LMNAHTTSMN1; SMN2GAAKMT2A
SCHEMBL23989363 0.77 LMNA (0.36) LMNAHTTSMN1; SMN2GAAKMT2A
SCHEMBL17793164 0.77 LMNA (0.36) LMNAHTTSMN1; SMN2GAAKMT2A
SCHEMBL292775 0.75
SCHEMBL17672754 0.75
SCHEMBL23174811 0.75 LMNA (0.38) LMNAHTTSMN1; SMN2GAAKMT2A
SCHEMBL20420208 0.74 TBXAS1 (0.46) LMNASMN1; SMN2GAAALDH1A1
SCHEMBL16769196 0.74 DUT (0.37) LMNAHTTSMN1; SMN2GAAKMT2A

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-3033336-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2018-05-30 EP disclosed