SCHEMBL3246772

SCHEMBL3246772

Clc1[c]ccc(CNc2ccc(Cl)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
RECQL P46063 1/20 0.46
MAPT P10636 4/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CNR2 P34972 1/20 0.44
HDAC1 Q13547 1/20 0.43
FFAR1 O14842 1/20 0.43
HDAC4 P56524 1/20 0.41
MEF2D Q14814 1/20 0.41
GAA P10253 2/20 0.40
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL3240341 0.87 LMNA (0.42) RAB9AMEN1KMT2ARECQLMAPT
SCHEMBL3246912 0.83 MAPT (0.45) MEN1KMT2AMAPTFFAR1L3MBTL1
SCHEMBL3249812 0.83 MEN1 (0.45) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL3242481 0.80 MAPT (0.43) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL3245776 0.78 MEN1 (0.56) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL3248749 0.76 HPGD (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL10945837 0.75 MEN1 (0.71) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL11512612 0.75 MEN1 (0.71) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL2500621 0.74 KDM4E (0.39) MAPT
SCHEMBL11512929 0.74 MEN1 (0.55) NPC1RAB9AMEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2185149-A1 USE OF KNCQ POTASSIUM CHANNEL OPENERS FOR REDUCING SYMPTOMS OF OR TREATING DISORDERS OR CONDITIONS WHEREIN THE DOPAMINERGIC SYSTEM IS DISRUPTED H. Lundbeck A/S (DK) 2010-05-19 EP claimed
WO-2009015667-A1 USE OF KNCQ POTASSIUM CHANNEL OPENERS FOR REDUCING SYMPTOMS OF OR TREATING DISORDERS OR CONDITIONS WHEREIN THE DOPAMINERGIC SYSTEM IS DISRUPTED H. LUNDBECK A/S (DK) 2009-02-05 WO claimed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
EP-2185149-A1 USE OF KNCQ POTASSIUM CHANNEL OPENERS FOR REDUCING SYMPTOMS OF OR TREATING DISORDERS OR CONDITIONS WHEREIN THE DOPAMINERGIC SYSTEM IS DISRUPTED H. Lundbeck A/S (DK) 2010-05-19 EP disclosed
WO-2009015667-A1 USE OF KNCQ POTASSIUM CHANNEL OPENERS FOR REDUCING SYMPTOMS OF OR TREATING DISORDERS OR CONDITIONS WHEREIN THE DOPAMINERGIC SYSTEM IS DISRUPTED H. LUNDBECK A/S (DK) 2009-02-05 WO disclosed