SCHEMBL8972695

SCHEMBL8972695

CCCCCCCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
KMT2A Q03164 5/20 0.51
MEN1 O00255 2/20 0.51
EBP Q15125 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
GNAI3 P08754 8/20 0.51
GNAI1 P63096 8/20 0.51
GNAO1 P09471 7/20 0.51
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP2C19 P33261 1/20 0.45

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
SCHEMBL8973029 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL18417667 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL8972946 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL8973347 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL8972961 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL8972169 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL8972586 1.00 L3MBTL1 (0.53) L3MBTL1KMT2AMEN1EBPSIGMAR1
SCHEMBL9723756 0.91 TERT (0.49) KMT2AMEN1TDP1POLBMAPT
SCHEMBL11690104 0.91 TERT (0.49) KMT2AMEN1TDP1POLBMAPT
SCHEMBL9723747 0.91 TERT (0.49) KMT2AMEN1TDP1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268222-B1 Penetration enhancers for transdermal delivery of systemic agents RES TRIANGLE PHARM LTD (US) 1996-03-27 EP disclosed
EP-0582065-A1 1-Oxohydrocarbyl-substituted azacyclohexanes compositions used as acid catalyst WHITBY RESEARCH, Inc. (US) 1994-02-09 EP disclosed
EP-0280703-B1 COMPOSITIONS COMPRISING 1-ACYL-SUBSTITUTED MORPHOLINES, THIOMORPHOLINES AND PIPERAZINES AND THEIR USES WHITBY RESEARCH INC (US) 1993-12-29 EP disclosed
US-5073544-A Penetration promoters WHITBY, INC. (US) 1991-12-17 US disclosed
US-4917896-A PIPERAZINE, MORPHOLINE OR THIOMORPHOLINE DERIVATIVE NELSON RESEARCH & DEVELOPMENT CO. (US) 1990-04-17 US disclosed
EP-0268222-A2 Penetration enhancers for transdermal delivery of systemic agents RESEARCH TRIANGLE PHARMACEUTICALS LTD. (US) 1988-05-25 EP disclosed