SCHEMBL31022005

SCHEMBL31022005

Cc1cc2c(cc1Br)c(I)nn2C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 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
SCHEMBL31021996 0.84 RORC (0.31) MAPK1
SCHEMBL4145572 0.84 MAPK1 (0.30) MAPK1
SCHEMBL16619784 0.84 CASP7 (0.31) MAPK1
SCHEMBL16620464 0.79 RXFP1 (0.39) MAPK1
SCHEMBL30084144 0.79 ELANE (0.34)
SCHEMBL16213479 0.79 TYMS (0.36) MAPK1
SCHEMBL19100294 0.75 CYP11B1 (0.33) MAPK1
SCHEMBL19671757 0.73 MAOA (0.36) MAPK1
SCHEMBL28209997 0.73 ACSS2 (0.35) MAPK1
SCHEMBL31021936 0.73 MAPK1 (0.34) MAPK1

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-2024158745-A1 INHIBITORS OF LRRK2 VANDERBILT UNIVERSITY (US) 2024-08-02 WO disclosed