SCHEMBL369985

SCHEMBL369985

ClC1CC1c1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 6/20 0.42
LMNA P02545 3/20 0.42
CCR1 P32246 2/20 0.42
CCR5 P51681 2/20 0.42
CCR8 P51685 2/20 0.42
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42
METAP1 P53582 1/20 0.42
BLM P54132 1/20 0.42
HIF1A Q16665 1/20 0.42
DOHH Q9BU89 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
TDP1 Q9NUW8 3/20 0.39
PARP16 Q8N5Y8 2/20 0.39
PARP3 Q9Y6F1 2/20 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
SCHEMBL8796079 0.82 ALDH1A1 (0.38) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL28168522 0.78 NPC1 (0.47) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL12143649 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL27921494 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL24867570 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL24868506 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL19013047 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL899802 0.78 NPC1 (0.47) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL20495641 0.75 MAOB (0.47) ALDH1A1MAPTNPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL27940047 0.75 PDE10A (0.40) ALDH1A1MAPTNPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104870422-A Novel amine derivative or salt thereof TOYAMA CHEMICAL CO LTD 2015-08-26 CN disclosed
EP-2593432-B1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS PFIZER LTD (GB) 2014-10-22 EP disclosed
EP-2593433-A2 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS Pfizer Limited (GB) 2013-05-22 EP disclosed
WO-2012007877-A2 CHEMICAL COMPOUNDS PFIZER LIMITED (GB) 2012-01-19 WO disclosed