SCHEMBL27366217

SCHEMBL27366217

CN1CCC(OCCNC(=O)I)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
NAMPT P43490 1/20 0.35
SCN1A P35498 3/20 0.35
SCN2A Q99250 3/20 0.35
SCN3A Q9NY46 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CHRM3 P20309 3/20 0.34
CHRM1 P11229 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
MLNR O43193 1/20 0.34
CHRM2 P08172 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HRH1 P35367 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL27369781 0.84 F2 (0.38) KDM4EATMNAMPTSCN1ASCN2A
SCHEMBL27307949 0.79 EPHX1 (0.45) MEN1KMT2AALDH1A1
SCHEMBL27369636 0.77 MEN1 (0.36) KDM4EATMNAMPTSCN1ASCN2A
SCHEMBL27369779 0.76 CA2 (0.36) KDM4EATMNAMPTSCN1ASCN2A
SCHEMBL27307953 0.75 CARM1 (0.43) NPC1
SCHEMBL27366224 0.75 MEN1 (0.36) KDM4EATMNAMPTMEN1KMT2A
SCHEMBL27369741 0.75 MEN1 (0.36) KDM4EATMNAMPTMEN1KMT2A
SCHEMBL27429200 0.73 PAOX (0.41) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL31630390 0.73 MEN1 (0.41) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL20224787 0.71 NPC1 (0.41) SCN1ASCN2ASCN3AMEN1KMT2A

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-2024054952-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 WO disclosed