SCHEMBL7974809

SCHEMBL7974809

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
BRD4 O60885 2/20 0.40
CHRNB2 P17787 2/20 0.40
CHRNA4 P43681 2/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
BRDT Q58F21 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38
GAA P10253 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.36
PDE4B Q07343 3/20 0.36

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
SCHEMBL12321755 0.83 EPHX1 (0.44) EPHX1BRD4CHRNB2CHRNA4CHRNB4
SCHEMBL7989438 0.81 GAA (0.59) BRD4L3MBTL1THRBATMGAA
SCHEMBL771231 0.79 BRD4 (0.40) EPHX1BRD4CHRNB2CHRNA4CHRNB4
SCHEMBL6609940 0.79 HPGD (0.55) EPHX1L3MBTL1USP2THRBALDH1A1
SCHEMBL7986443 0.79 GPR119 (0.43) PDE4B
SCHEMBL7989633 0.79 EPHX2 (0.44) EPHX1BRD4CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL771849 0.79 BRD4 (0.44) EPHX1BRD4CHRNB2CHRNA4CHRNB4
SCHEMBL19157739 0.78 EPHX1 (0.41) EPHX1BRD4CHRNB2CHRNA4CHRNB4
SCHEMBL14999239 0.78 EPHX1 (0.38) EPHX1BRD4CHRNB2CHRNA4CHRNB4
SCHEMBL10193812 0.77 BRD4 (0.41) EPHX1BRD4CHRNB2CHRNA4CHRNB4

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