SCHEMBL9800227

SCHEMBL9800227

NC(=O)[C@H]1CCCC[C@@H]1C(N)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.67
GRM4 Q14833 1/20 0.47
PSEN1 P49768 3/20 0.42
PSEN2 P49810 3/20 0.42
APH1B Q8WW43 3/20 0.42
NCSTN Q92542 3/20 0.42
APH1A Q96BI3 3/20 0.42
PSENEN Q9NZ42 3/20 0.42
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
ALOX5 P09917 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
CYP2D6 P10635 1/20 0.37
GLI1 P08151 1/20 0.37
NOS2 P35228 1/20 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
SCHEMBL1570434 1.00 EPHX1 (0.67) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL13557474 1.00 EPHX1 (0.67) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL9800070 1.00 EPHX1 (0.67) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL17205447 1.00 EPHX1 (0.67) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL2343227 0.93 EPHX1 (0.59) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL7362431 0.93 EPHX1 (0.59) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL7818915 0.89 EPHX1 (0.56) EPHX1GRM4ALDH1A1LMNAKMT2A
SCHEMBL17846562 0.89 EPHX1 (0.56) EPHX1GRM4PSEN1PSEN2APH1B
SCHEMBL7815469 0.89 EPHX1 (0.56) EPHX1GRM4ALDH1A1LMNAKMT2A
SCHEMBL7815466 0.89 EPHX1 (0.56) EPHX1GRM4ALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10030483-B2 Carbon dioxide and hydrocarbon assisted enhanced oil recovery GENERAL ELECTRIC COMPANY (US) 2018-07-24 US disclosed
US-20170114269-A1 CARBON DIOXIDE AND HYDROCARBON ASSISTED ENHANCED OIL RECOVERY BAKER HUGHES, A GE COMPANY, LLC 2017-04-27 US disclosed
EP-0174572-B1 CYCLOHEXANE-1,2-DICARBOXYLIC AMIDES, IONIC-SELECTIVES MEMBRANES AND TEST APPARATUS CONTAINING THESE COMPOUNDS Willi Möller AG (CH) 1991-03-06 EP disclosed