SCHEMBL24837487

SCHEMBL24837487

CN1CCCC(O)(CC#N)C1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL25165002 0.78
SCHEMBL14413861 0.76 CYP2D6 (0.36) USP2NPSR1
SCHEMBL24837477 0.76 USP2 (0.36) USP2NPSR1
SCHEMBL23268386 0.75 USP2 (0.35) USP2
SCHEMBL13798801 0.74 ROCK2 (0.31)
SCHEMBL11245376 0.73
SCHEMBL10515290 0.72 USP2 (0.37) USP2
SCHEMBL10163094 0.71 ALDH1A1 (0.48) USP2ALDH1A1NPSR1
SCHEMBL11253304 0.71 ALDH1A1 (0.46) USP2ALDH1A1
SCHEMBL11371451 0.71 ALDH1A1 (0.46) USP2ALDH1A1

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-2022250170-A9 SMALL MOLECULE INHIBITORS OF KRAS MUTATED PROTEINS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2023-01-05 WO disclosed