SCHEMBL31729323

SCHEMBL31729323

OCc1nn(C2CC2)cc1Br

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.32
EPHX2 P34913 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
SCHEMBL31081561 0.93 AADAT (0.36) EPHX2
SCHEMBL31670737 0.78 LRRK2 (0.33) PDE4D
SCHEMBL21281701 0.78 PDE4D (0.35) PDE4D
SCHEMBL31413853 0.75 ALDH1A1 (0.36)
SCHEMBL31727884 0.74 KDM1A (0.34) PDE4D
SCHEMBL25111998 0.71 AADAT (0.31)
SCHEMBL20689124 0.71 KDM5A (0.42) PDE4D
SCHEMBL31728876 0.71
SCHEMBL25337033 0.69 EPHX2 (0.37) EPHX2
SCHEMBL31614261 0.68 KCNH2 (0.40) PDE4D

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-2025235874-A1 HETEROCYCLICS AS EGFR INHIBITORS SCHRÖDINGER, INC. (US) 2025-11-13 WO disclosed