SCHEMBL7647437

SCHEMBL7647437

Cc1cc(C)c(C2C(=O)NC3(CCCC(C)(C)C3)C2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.32
PDE7A Q13946 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL8645554 0.86 KMT2A (0.38) KMT2APDE7ANPC1RAB9A
SCHEMBL8652013 0.85 KMT2A (0.40) KMT2APDE7ANPC1RAB9A
SCHEMBL7612862 0.78 CA12 (0.34) KMT2APDE7A
SCHEMBL6762179 0.77 HPGD (0.30)
SCHEMBL7619891 0.77 THRB (0.39) PDE7A
SCHEMBL7614542 0.76 ATM (0.33) KMT2ANPC1RAB9A
SCHEMBL9410107 0.76 NPC1 (0.31) NPC1RAB9A
SCHEMBL2889210 0.75 KMT2A (0.41) KMT2APDE7ANPC1RAB9A
SCHEMBL3176738 0.75 PDE7A (0.35) KMT2APDE7ANPC1RAB9A
SCHEMBL6762325 0.75

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
EP-0596298-B1 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides BAYER AG (DE) 2002-01-09 EP disclosed
US-5677449-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-10-14 US disclosed
US-5462913-A Pesticides, insecticides, miticides, herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0596298-A2 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides BAYER AG (DE) 1994-05-11 EP disclosed