SCHEMBL26259409

SCHEMBL26259409

CC(=O)N1CCC(NC(C)O)CC1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.53
EPHX1 P07099 4/20 0.53
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PIK3CD O00329 1/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL12258967 0.86 EPHX2 (0.59) EPHX2EPHX1PIK3CDMAPTCYP1A2
SCHEMBL23977661 0.84 EPHX2 (0.53) EPHX2EPHX1KDM1AMAOAMAOB
SCHEMBL20403049 0.82 EPHX2 (0.51) EPHX2EPHX1KDM1AMAOAMAOB
SCHEMBL315541 0.79 EPHX2 (0.56) EPHX2EPHX1KDM1AMAOAMAOB
SCHEMBL9891911 0.78 EPHX2 (0.61) EPHX2EPHX1
SCHEMBL23041884 0.78 EPHX2 (0.61) EPHX2EPHX1
SCHEMBL21322299 0.77 OPRK1 (0.52) EPHX2EPHX1PIK3CDMAPT
SCHEMBL2888489 0.77 EPHX2 (0.58) EPHX2EPHX1KDM1AMAOAMAOB
SCHEMBL21077935 0.77 POLB (0.36) KDM1A
SCHEMBL3317493 0.77 EPHX2 (0.58) EPHX2EPHX1KDM1AMAOAMAOB

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
EP-4209485-A1 COMPOUND HAVING ANTITUMOR ACTIVITY AND USE THEREOF Innovstone Therapeutics Limited (CN) 2023-07-12 EP disclosed