SCHEMBL8319920

SCHEMBL8319920

COCOc1ccc(C(CC(N)=O)c2cccnc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.48
LMNA P02545 4/20 0.46
FFAR1 O14842 3/20 0.45
TBXAS1 P24557 3/20 0.41
HTT P42858 2/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.39
KCNA5 P22460 3/20 0.39
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL8313802 0.90 FFAR1 (0.53) PDE4DLMNAFFAR1TBXAS1HTT
SCHEMBL8317319 0.84 KCNA5 (0.40) PDE4DFFAR1TBXAS1KCNA5
SCHEMBL17591689 0.82 LMNA (0.54) PDE4DLMNATBXAS1HTTHPGD
SCHEMBL9311940 0.81 HRH1 (0.42) PDE4DFFAR1TBXAS1KCNA5KMT2A
SCHEMBL9312935 0.81 PDE4D (0.40) PDE4DFFAR1TBXAS1KCNA5MAPT
SCHEMBL8553222 0.79 PDE4D (0.49) PDE4DFFAR1RAB9A
SCHEMBL8318114 0.78 SMN1; SMN2 (0.57) LMNASMN1; SMN2GAA
SCHEMBL8317214 0.78 PBRM1 (0.42) PDE4DFFAR1KCNA5
Ammonia Solution, Strong SCHEMBL8317322 0.76 TBXAS1 (0.44) TBXAS1KCNA5MAPT
SCHEMBL6509102 0.75 ADRB3 (0.38) PDE4DLMNASMN1; SMN2KCNA5KMT2A

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-0897920-A1 NOVEL HETEROCYCLIC COMPOUNDS HAVING PLATELET AGGREGATION INHIBITORY EFFECTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-02-24 EP disclosed