SCHEMBL7989633

SCHEMBL7989633

[CH2]OC1CCN(C(C)=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.44
EPHX1 P07099 2/20 0.43
CYP1A2 P05177 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
QDPR P09417 2/20 0.39
BRD4 O60885 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
CREBBP Q92793 1/20 0.37
IKBKB O14920 1/20 0.37

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
SCHEMBL23134531 0.82 CYP1A2 (0.46) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL6043112 0.80 CYP1A2 (0.44) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL7974809 0.79 EPHX1 (0.42) EPHX1CYP1A2SMN1; SMN2BRD4ALDH1A1
SCHEMBL12703331 0.78 EPHX2 (0.43) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL18773654 0.78 EPHX2 (0.43) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL17320473 0.78 EPHX2 (0.43) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL771761 0.78 EPHX2 (0.40) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL4694190 0.77 EPHX2 (0.42) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL7989438 0.76 GAA (0.59) TDP1KDM4ESMN1; SMN2BRD4ALDH1A1
SCHEMBL13310435 0.76 EPHX2 (0.39) EPHX2EPHX1CYP1A2TDP1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed