SCHEMBL22224006

SCHEMBL22224006

Cc1ncc2snc(C)c2n1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.31
ALDH1A1 P00352 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
SCHEMBL24756696 0.79 CLK1 (0.33) GRM4
SCHEMBL7919450 0.70 CCR1 (0.46)
SCHEMBL16417538 0.70 GRM4 (0.34) GRM4
SCHEMBL19370366 0.68 CCR1 (0.30)
SCHEMBL19920424 0.68 PDPK1 (0.34)
SCHEMBL7922387 0.68 CCR1 (0.43) GRM4
SCHEMBL17813446 0.68 PDK2 (0.32)
SCHEMBL24756692 0.67 NOS3 (0.43) ALDH1A1
SCHEMBL15472011 0.67
SCHEMBL17927559 0.65 GRM4 (0.40) GRM4

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
WO-2020146858-A1 HETEROARYL COMPOUNDS AS NECROSIS INHIBITORS, COMPOSITION AND METHOD USING THE SAME ACCRO BIOSCIENCE INC. (KY) 2020-07-16 WO disclosed