SCHEMBL8468019

SCHEMBL8468019

CCCCCCCCCCOCCC(=O)NCc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.74
FAAH O00519 2/20 0.64
CNR2 P34972 2/20 0.61
CNR1 P21554 1/20 0.61
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
GAA P10253 1/20 0.58
TSHR P16473 2/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
RECQL P46063 1/20 0.57
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.52

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
SCHEMBL14112016 0.87 EPHX2 (0.67) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL26576519 0.87 EPHX2 (0.61) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL26576518 0.87 EPHX2 (0.61) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL2524088 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL29052372 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
N-Benzyldodecanamide SCHEMBL3977374 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL2166861 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
Nonanoic Acid Benzylamide SCHEMBL3280214 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL5696750 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1
SCHEMBL5471650 0.85 EPHX2 (1.00) EPHX2FAAHCNR2CNR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5981580-A IN WHICH THE CARBOXY-TERMINUS HAS BEEN MODIFIED TO FORM VARIOUS AMIDES, ESTERS, KETONES, ALCOHOLS, ALCOHOL ESTERS AND NITRITES THEREOF, AND ARE USEFUL AS SUBSTRATES FOR N-MYRISTOYLTRANSFERASE (NMT) AND/OR ITS ACYL COENZYME G. D. SEARLE & CO. (US) 1999-11-09 US disclosed
US-5929110-A USEFUL AS SUBSTRATES FOR N-MYRISTOYLTRANSFERASE (NMT) AND/OR ITS ACYL COENZYME, AND AS ANTI-VIRAL AND ANTI-FUNGAL AGENTS OR PRO-DRUGS OF SUCH AGENTS G. D. SEARLE & CO. (US) 1999-07-27 US disclosed
US-5859052-A TREATING LENTIVIRUS INFECTIONS, ESPECIALLY HUMAN IMMUNODEFICIENCY VIRUS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed
US-5744631-A Fatty acid analogs and prodrugs G.D. SEARLE & CO. (US) 1998-04-28 US disclosed
US-5719290-A METHYLOXYUNDECYL- OR DECYLOXYETHYL-NITRILE OR TETRAZOLE DERIVATIVES; VIRICIDES G. D. SEARLE & CO. (US) 1998-02-17 US disclosed
US-5672769-A CHEMICAL INTERMEDIATES FOR VIRICIDES, FUNGICIDES G. D. SEARLE & CO. (US) 1997-09-30 US disclosed
US-5599947-A VIRICIDES, FUNGICIDES OR THEIR PRODRUGS G. D. SEARLE & CO. (US) 1997-02-04 US disclosed