SCHEMBL25078298

SCHEMBL25078298

C=NNC1CCN(C(C)=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.51
EPHX1 P07099 4/20 0.51
MAPT P10636 1/20 0.40
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL23546344 0.78 TEAD1 (0.44)
SCHEMBL315541 0.78 EPHX2 (0.56) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL17572041 0.77 EPHX2 (0.47) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL23546492 0.76 EPHX1 (0.58) EPHX2EPHX1MAPT
SCHEMBL3317493 0.75 EPHX2 (0.58) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL2888489 0.75 EPHX2 (0.58) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL4569279 0.74 EPHX2 (0.56) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL12850168 0.74 EPHX2 (0.56) EPHX2EPHX1MAPTKDM1AMAOA
SCHEMBL13852062 0.74 EPHX2 (0.56) EPHX2EPHX1MAPTKDM1AMAOA
Hydrochloric Acid SCHEMBL11313043 0.74 EPHX2 (0.56) EPHX2EPHX1MAPTKDM1AMAOA

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-2023022497-A1 SOS1 INHIBITOR AND USE THEREOF 주식회사 카나프테라퓨틱스 2023-02-23 WO disclosed