SCHEMBL20117675

SCHEMBL20117675

CNc1cccc([C@@H]2COC(=O)N2C)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
P2RX7 Q99572 2/20 0.34
IDH1 O75874 8/20 0.33
SCD5 Q86SK9 1/20 0.32

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
SCHEMBL2235912 0.79 DDB1 (0.38) BRD4P2RX7SCD5
SCHEMBL16181380 0.79 MDM2 (0.48)
SCHEMBL2235902 0.79 DDB1 (0.38) BRD4P2RX7SCD5
SCHEMBL16181385 0.79 CYP19A1 (0.45)
SCHEMBL5286742 0.78 IDH1 (0.43) IDH1
SCHEMBL5281444 0.78 IDH1 (0.43) IDH1
SCHEMBL2615701 0.78 IDH1 (0.43) IDH1
SCHEMBL2308887 0.76 KDM1A (0.47)
SCHEMBL2236980 0.75 LMNA (0.48)
SCHEMBL2236969 0.75 LMNA (0.48)

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-2349990-B1 ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE PIMCO 2664 LTD (GB) 2018-05-02 EP disclosed