SCHEMBL18397243

SCHEMBL18397243

CCc1ccc(CCBr)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.44
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 1/20 0.42
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
NFKB1 P19838 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL10090177 0.84 HRH3 (0.56) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL662136 0.83 HRH3 (0.46) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL30398570 0.81 HRH3 (0.55) HRH3CYP1A2CYP2D6L3MBTL1NPC1
SCHEMBL487617 0.81 HRH3 (0.55) HRH3CYP1A2CYP2D6L3MBTL1NPC1
SCHEMBL2619347 0.80 NFKB1 (0.54) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL16935090 0.80 TAAR1 (0.54) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL18397399 0.79 PIK3CD (0.40) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL31190152 0.78 RAB9A (0.51) HRH3CYP1A2TDP1L3MBTL1NFKB1
Ammonia Solution, Strong SCHEMBL7978427 0.78 NFKB1 (0.53) HRH3CYP1A2CYP2D6TDP1L3MBTL1
SCHEMBL20415539 0.77 HRH3 (0.41) HRH3CYP1A2CYP2D6TDP1L3MBTL1

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-3325471-A1 COLONY STIMULATING FACTOR-1 RECEPTOR (CSF-1R) INHIBITORS Genzyme Corporation (US) 2018-05-30 EP disclosed
WO-2017015267-A1 COLONY STIMULATING FACTOR-1 RECEPTOR (CSF-1R) INHIBITORS GENZYME CORPORATION (US) 2017-01-26 WO disclosed