SCHEMBL27080337

SCHEMBL27080337

CC(=O)N1CC2(CC(NC(=O)O)C2)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EPHX1 P07099 4/20 0.37
EPHX2 P34913 12/20 0.36
CD274 Q9NZQ7 2/20 0.34
PDCD1LG2 Q9BQ51 1/20 0.34
PDCD1 Q15116 1/20 0.34
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 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
SCHEMBL18497935 0.81 KDM4E (0.31) ALDH1A1
SCHEMBL26812225 0.81 SMN1; SMN2 (0.44) KDM1ASMN1; SMN2EPHX1EPHX2CD274
SCHEMBL27172421 0.77 CTSK (0.43) EPHX2
SCHEMBL23992147 0.76 SMN1; SMN2 (0.40) KDM1ASMN1; SMN2EPHX1EPHX2CD274
SCHEMBL19872412 0.76 CD274 (0.41) KDM1ASMN1; SMN2EPHX1EPHX2CD274
SCHEMBL19856437 0.76 EPHX1 (0.37) KDM1ASMN1; SMN2EPHX1EPHX2
SCHEMBL16891677 0.75 CYP2C19 (0.56) KDM1ASMN1; SMN2EPHX2ALDH1A1MAPK1
SCHEMBL15820963 0.74 CHRNB2 (0.45) SMN1; SMN2EPHX1EPHX2
SCHEMBL25677360 0.74 SMN1; SMN2 (0.48) KDM1ASMN1; SMN2EPHX1EPHX2CD274
SCHEMBL25769751 0.74 CD274 (0.39) KDM1ASMN1; SMN2EPHX1EPHX2CD274

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
WO-2024069448-A1 SUBSTITUTED 1-ARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1-HETEROARYLAMINOCARBONYL-1'-HETEROARYL COMPOUNDS AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-04-04 WO disclosed
EP-4313968-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2024-02-07 EP disclosed
WO-2022237858-A1 COMPOUND HAVING ANTI-TUMOR ACTIVITY AND USE THEREOF 上海翊石医药科技有限公司 2022-11-17 WO disclosed