SCHEMBL7097149

SCHEMBL7097149

O=C(NCCCCCc1ccc(Cl)cc1)C1CCc2[nH]cnc2C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GPBAR1 Q8TDU6 4/20 0.41
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39

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
SCHEMBL6850877 0.81 KDM4E (0.50) POLBKDM4EALDH1A1RAB9AKMT2A
SCHEMBL6850920 0.79 NPC1 (0.41) KDM4EALDH1A1NPC1RAB9AKMT2A
SCHEMBL6846948 0.77 KDM4E (0.40) POLBKDM4EALDH1A1KMT2A
SCHEMBL6846803 0.76 CCR2 (0.41) POLBALDH1A1NPC1RAB9ALMNA
SCHEMBL6849677 0.76 L3MBTL1 (0.43) POLBKDM4EALDH1A1NPC1RAB9A
SCHEMBL6846909 0.76 LMNA (0.45) POLBLMNA
Hydrochloric Acid SCHEMBL6851033 0.75 L3MBTL1 (0.42) POLBKDM4EALDH1A1NPC1RAB9A
Hydrochloric Acid SCHEMBL7096357 0.75 LMNA (0.44) POLBLMNA
SCHEMBL6847031 0.74 ALDH1A1 (0.52) ALDH1A1KMT2ALMNAHTT
SCHEMBL6849763 0.74 KDM4E (0.49) KDM4EALDH1A1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 WO disclosed