SCHEMBL21779999

SCHEMBL21779999

C=C(OCC)c1nc(Cl)nc2nc(SC)sc12

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL21769050 0.84 LMNA (0.49) KDRLMNA
SCHEMBL21769073 0.83 KDM4E (0.32)
SCHEMBL20489601 0.72 KDR (0.47) KDR
SCHEMBL28459326 0.72 MAPT (0.31)
SCHEMBL20489651 0.72 KDR (0.50) KDR
SCHEMBL20784791 0.70 GLP1R (0.33)
SCHEMBL21769056 0.70 KDR (0.61) KDR
SCHEMBL20784911 0.68 MAPT (0.35)
SCHEMBL3654478 0.68 ADORA2A (0.40) LMNA
SCHEMBL16398352 0.67 NPC1 (0.31)

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-3616753-A1 COMPOUNDS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR Corvus Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed