SCHEMBL8894973

SCHEMBL8894973

CCCCCCN(CCCCCC)N1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
LTA4H P09960 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33

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
SCHEMBL28915967 1.00 DNM1 (0.42) DNM1L3MBTL1TSHRTHRBMEN1
SCHEMBL26160891 0.98 DNM1 (0.41) DNM1L3MBTL1TSHRTHRBMEN1
SCHEMBL10444399 0.98 DNM1 (0.39) DNM1L3MBTL1TSHRTHRBMEN1
SCHEMBL4722516 0.91 L3MBTL1 (0.34) L3MBTL1MEN1KMT2ATDP1SIGMAR1
Bromide SCHEMBL5550994 0.89 TSHR (0.41) DNM1L3MBTL1TSHRMEN1KMT2A
SCHEMBL4723247 0.88 L3MBTL1 (0.36) L3MBTL1TSHRMEN1KMT2ATDP1
Bromide SCHEMBL5547782 0.87 TSHR (0.40) DNM1L3MBTL1TSHRMEN1KMT2A
SCHEMBL4724012 0.86 SIGMAR1 (0.35) L3MBTL1MEN1KMT2ATDP1SIGMAR1
SCHEMBL8607396 0.86 SIGMAR1 (0.33) L3MBTL1SIGMAR1
SCHEMBL4722021 0.84 L3MBTL1 (0.34) L3MBTL1MEN1KMT2ATDP1SIGMAR1

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-5677285-A PERACYLATION; SALT FORMATION FIDIA S.P.A. (IT) 1997-10-14 US claimed
EP-0652887-A1 NEW DERIVATIVES OF NEURAMINIC ACID FIDIA S.p.A. (IT) 1995-05-17 EP claimed
WO-1994003469-A1 NEW DERIVATIVES OF NEURAMINIC ACID FIDIA S.P.A. (IT) 1994-02-17 WO claimed