SCHEMBL29923256

SCHEMBL29923256

CCc1cnc2cc(C)cc(Br)c2c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.35
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
RXRA P19793 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31

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
SCHEMBL24916133 1.00 PSMB5 (0.35) PSMB5PDGFRBPDGFRARXRAGRIN1
SCHEMBL29923857 0.77 MAPT (0.34)
SCHEMBL24916128 0.77 MAPT (0.34)
SCHEMBL24915595 0.77 PSMB5 (0.33) PSMB5PDGFRBPDGFRA
SCHEMBL24916284 0.76 MAPT (0.37)
SCHEMBL31353505 0.75 PSMB5 (0.37) PSMB5PDGFRBPDGFRA
SCHEMBL18123538 0.74 CYP1A2 (0.41) RXRAGRIN1GRIN2B
SCHEMBL29923786 0.72 PSMB5 (0.35) PSMB5PDGFRBPDGFRA
SCHEMBL24916495 0.72 PSMB5 (0.35) PSMB5PDGFRBPDGFRA
SCHEMBL18123545 0.70 KCNH2 (0.39)

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-4055013-A1 WDR5 INHIBITORS AND MODULATORS Vanderbilt University (US) 2022-09-14 EP disclosed