SCHEMBL7781028

SCHEMBL7781028

Cc1cc(C)c(C2C(=O)NC(C)(C3CCCC3)C2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
CRBN Q96SW2 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.31
TAS1R1 Q7RTX1 2/20 0.31
TAS1R2 Q8TE23 2/20 0.31

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
SCHEMBL7780291 0.94 CRBN (0.33) HTR7HTR2BTMEM97SIGMAR1CRBN
SCHEMBL7780300 0.89 HTR7 (0.31) HTR7HTR2BTMEM97SIGMAR1CRBN
SCHEMBL7778443 0.85 CHRM2 (0.30)
SCHEMBL3596041 0.84 KMT2A (0.33) CRBN
SCHEMBL1359272 0.83 HTR7 (0.32) HTR7HTR2BTMEM97SIGMAR1
SCHEMBL7773621 0.80 CRBN (0.33) CRBN
SCHEMBL9001226 0.78 TAS1R3 (0.30) TAS1R3TAS1R1TAS1R2
SCHEMBL6314284 0.77 L3MBTL1 (0.34)
SCHEMBL8648027 0.77 GRIN2D (0.35) HTR7HTR2BTMEM97SIGMAR1CRBN
SCHEMBL7781016 0.76 DDB1 (0.36) CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0613885-B1 Subsituted 1-H-3-phenyl-5-cycloalkyl-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides BAYER AG (DE) 2001-09-19 EP disclosed
US-5567671-A HERBICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-10-22 US disclosed
EP-0613885-A2 Subsituted 1-H-3-phenyl-5-cycloalkyl-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides BAYER AG (DE) 1994-09-07 EP disclosed