SCHEMBL17540757

SCHEMBL17540757

CCCCCCCCCCCCCCCCCC(=O)C(O)C(O)(C(=O)CCCCCCCCCCCCCCC)C(O)C(=O)CCCCCCCCCCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.50
CES1 P23141 5/20 0.50
CES2 O00748 3/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL7085256 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL2827903 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL2733841 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL25300764 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL2734708 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL25299017 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL3344018 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL1286332 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL16721005 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL9754723 1.00 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200155575-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2020-05-21 US claimed
US-20190269700-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2019-09-05 US claimed
US-20180078568-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2018-03-22 US claimed
US-20160184324-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2016-06-30 US claimed
US-20200155575-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2020-05-21 US disclosed
US-20190269700-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2019-09-05 US disclosed
US-20180104257-A1 (17-ß)-3-Oxoandrost-4-En-17-Yl Undecanoate Compositions and Methods of Their Preparation and Use LIPOCINE INC. (US) 2018-04-19 US disclosed
US-20180078568-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2018-03-22 US disclosed
EP-3185873-A1 PHARMACEUTICAL COMPOSITION AND METHODS Lipocine Inc. (US) 2017-07-05 EP disclosed
US-20160193225-A1 (17-ß)-3-OXOANDROST-4-EN-17-YL UNDECANOATE COMPOSITIONS AND METHODS OF THEIR PREPARATION AND USE LIPOCINE INC. (US) 2016-07-07 US disclosed
US-20160184324-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2016-06-30 US disclosed
WO-2016033536-A1 PHARMACEUTICAL COMPOSITION AND METHODS LIPOCINE INC. (US) 2016-03-03 WO disclosed
WO-2016033611-A1 (17-β)-3-OXOANDROST-4-EN-17-YL UNDECANOATE COMPOSITIONS AND METHODS OF THEIR PREPARATION AND USE LIPOCINE INC. (US) 2016-03-03 WO disclosed