SCHEMBL8322503

SCHEMBL8322503

Cc1nc2cnccc2n1CCC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PTAFR P25105 5/20 0.41

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
SCHEMBL8322125 0.82 L3MBTL1 (0.46) KDM4EPTAFR
SCHEMBL7499604 0.81 STING1 (0.49)
SCHEMBL8321832 0.78 GAA (0.50) PTAFR
SCHEMBL8565849 0.76 PTAFR (0.47) PTAFR
SCHEMBL9691244 0.76 KMT2A (0.57) KDM4EALDH1A1PTAFR
SCHEMBL8317845 0.75 PTAFR (0.44) PTAFR
SCHEMBL8883493 0.74 PTAFR (0.51) PTAFR
SCHEMBL9691929 0.74 PTAFR (0.45) PTAFR
SCHEMBL6157116 0.74 GPR119 (0.48) KDM4E
SCHEMBL8882903 0.73 PTAFR (0.49) PTAFR

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
US-5866588-A DUAL HISTAMINE (H1) AND PLATELET ACTIVATING FACTOR (PAF) RECEPTOR ANTAGONISTS. BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 1999-02-02 US disclosed