SCHEMBL7057536

SCHEMBL7057536

CCCC[N]CCC(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
OPRM1 P35372 1/20 0.35
SPHK1 Q9NYA1 1/20 0.33
LMNA P02545 2/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31
PLA2G1B P04054 1/20 0.31
PLA2G2A P14555 1/20 0.31
NAAA Q02083 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ACE2 Q9BYF1 1/20 0.30

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
SCHEMBL967504 0.92 DNM1 (0.40) DNM1TSHRTHRBOPRM1SPHK1
SCHEMBL7058524 0.90 LMNA (0.38) DNM1TSHRTHRBOPRM1SPHK1
SCHEMBL489808 0.83
SCHEMBL158837 0.83 LMNA (0.35) TSHRLMNA
SCHEMBL7057669 0.82 DNM1 (0.40) DNM1TSHRTHRBOPRM1SPHK1
SCHEMBL2531 0.80
SCHEMBL277920 0.77 LMNA (0.45) LMNA
SCHEMBL9244698 0.76 TSHR (0.50) DNM1TSHRTHRBLMNANAAA
SCHEMBL6181599 0.76 TSHR (0.50) DNM1TSHRTHRBLMNANAAA
SCHEMBL271457 0.76

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
EP-0994108-B1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-05-14 EP disclosed
US-6197970-B1 REACTING WITH SECONDARY OR TERTIARY AMINE; DEBLOCKING, DEPROTECTING ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-0994108-A1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP disclosed