SCHEMBL7607872

SCHEMBL7607872

CCCCCCCCCN(c1ccccc1)c1ccccc1CCCCCCCC.CCCCCCCCCc1ccccc1N(CCCCCCCCC)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
NPC1 O15118 1/20 0.42
JAK2 O60674 1/20 0.42
RAB9A P51151 1/20 0.42
PAX8 Q06710 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
TLR8 Q9NR97 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40

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
SCHEMBL28359295 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL3451238 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL28543067 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL3450720 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL17440487 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL10869649 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL4559051 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL986349 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL109304 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A
SCHEMBL28546509 1.00 KCNH2 (0.46) KCNH2LIPGNPC1JAK2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1002027-B1 GREASE CONTAINING DIAMINE CORROSION INHIBITORS EXXONMOBIL RES & ENG CO (US) 2002-12-18 EP disclosed