SCHEMBL9018925

SCHEMBL9018925

ClCc1ccc2cccc(Cl)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
XPO1 O14980 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CCR1 P32246 2/20 0.39
AR P10275 1/20 0.38
PARP1 P09874 1/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
LMNA P02545 3/20 0.35
PDE10A Q9Y233 2/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34

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
SCHEMBL17179178 0.82 FAAH (0.42) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL5365121 0.82 FAAH (0.42) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL28887382 0.82 FAAH (0.42) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL13010265 0.82 PARP1 (0.54) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL29518341 0.82 CCR1 (0.63) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL201143 0.82 CCR1 (0.63) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL31648790 0.80 CCR1 (0.56) ALDH1A1TDP1L3MBTL1CCR1PARP1
SCHEMBL8944345 0.80 CCR1 (0.56) ALDH1A1TDP1L3MBTL1CCR1PARP1
SCHEMBL14126759 0.79 PDE10A (0.41) FAAHHDAC1HDAC2HDAC8HDAC6
SCHEMBL14351724 0.79 TAAR1 (0.47) FAAHHDAC1HDAC2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0414019-B1 Subsituted N-(quinolin-2-yl-methoxy)benzylsulfonylureas BAYER AG (DE) 1996-05-29 EP disclosed
US-5179106-A SUBSTITUTED N-(QUINOLIN-2-YL-METHOXY) BENZYL-SULPHONYLUREA LEUKOTRIENE SYNTHESIS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed
US-5045547-A Leukotriene-inhibiting substituted (quinolin-2-yl-methoxy)phenyl-N,N'-sulphonylureas and use thereas BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed
EP-0414019-A2 Subsituted N-(quinolin-2-yl-methoxy)benzylsulfonylureas BAYER AG (DE) 1991-02-27 EP disclosed
CN-1045778-A (quinolin-2-ylmethoxy) phenyl-N that replaces, N '-sulfonylurea, its preparation method and the application in medicine thereof BAYER AG (DE) 1990-10-03 CN disclosed
EP-0387610-A2 Substituted (quinolin-2-yl methoxy)phenyl-N,N'-sulphonyl ureas, processes for their preparation and their use in medicines BAYER AG (DE) 1990-09-19 EP disclosed