SCHEMBL8554454

SCHEMBL8554454

CCC1(CC)NC(=O)C(c2ccc(Cl)cc2C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNB4 O00305 1/20 0.35
CACNA1A O00555 1/20 0.35
CACNA1G O43497 1/20 0.35
CACNG3 O60359 1/20 0.35
CACNA1F O60840 1/20 0.35
CACNA1H O95180 1/20 0.35
CACNB3 P54284 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CACNG7 P62955 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNA1D Q01668 1/20 0.35
CACNB1 Q02641 1/20 0.35
CACNG1 Q06432 1/20 0.35
CACNB2 Q08289 1/20 0.35
CACNA1S Q13698 1/20 0.35
CACNA1C Q13936 1/20 0.35
CACNA1E Q15878 1/20 0.35
CACNA2D4 Q7Z3S7 1/20 0.35
CACNA2D3 Q8IZS8 1/20 0.35
CACNG8 Q8WXS5 1/20 0.35

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
SCHEMBL8863015 0.86 MEN1 (0.35) GAAMAPTLMNAHPGDKDM4E
SCHEMBL4433853 0.84 ADAM17 (0.39) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL8555344 0.81 CACNB4 (0.38) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL8558103 0.76 MDM2 (0.33) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL8862581 0.75 MEN1 (0.34) GAAMAPTLMNASMN1; SMN2HPGD
SCHEMBL11025895 0.71 ACACB (0.43) TAAR1
SCHEMBL8557122 0.68 GAA (0.42) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL8863034 0.66 MEN1 (0.33) LMNAHPGDKDM4EALDH1A1
SCHEMBL5231465 0.65 SLC9A1 (0.41) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL8862650 0.64 MEN1 (0.36) MAPTLMNASMN1; SMN2HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847211-A Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0668267-B1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1998-04-08 EP disclosed
US-5622917-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
EP-0668267-A1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1995-08-23 EP disclosed