SCHEMBL24916133

SCHEMBL24916133

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
SCHEMBL29923256 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4055013-B1 WDR5 INHIBITORS AND MODULATORS UNIV VANDERBILT (US) 2024-03-20 EP disclosed
US-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 US disclosed
US-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 PSMB5 400/4885PDGFRB 4630/4885PDGFRA 4571/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.