SCHEMBL3406483

SCHEMBL3406483

Cc1ccc(Br)cc1CCO

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.39
CHEK1 O14757 1/20 0.38
ALDH1A1 P00352 4/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
PYCR1 P32322 1/20 0.34
CYP1A2 P05177 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
CYP2A6 P11509 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL29781225 1.00 TAAR1 (0.39) TAAR1CHEK1ALDH1A1PTGDR2FFAR4
SCHEMBL5820 0.83 PYCR1 (0.45) CHEK1ALDH1A1PYCR1MAPTMEN1
SCHEMBL606473 0.83 PTGDR2 (0.44) CHEK1ALDH1A1PTGDR2FFAR4PYCR1
SCHEMBL14222335 0.81 TAAR1 (0.41) TAAR1ALDH1A1PYCR1CYP1A2MAPT
SCHEMBL6542411 0.80 CHEK1 (0.41) CHEK1ALDH1A1PTGDR2CYP1A2SLC6A2
SCHEMBL3406480 0.79 TAAR1 (0.39) TAAR1ALDH1A1FFAR4PYCR1MAPT
SCHEMBL4951267 0.79 PYCR1 (0.45) TAAR1ALDH1A1FFAR4PYCR1MAPT
SCHEMBL6911967 0.79 TAAR1 (0.64) TAAR1CHEK1ALDH1A1
SCHEMBL1569443 0.78 CHEK1 (0.40) CHEK1ALDH1A1PTGDR2CYP1A2SLC6A2
SCHEMBL29710612 0.78 CHEK1 (0.40) CHEK1ALDH1A1PTGDR2CYP1A2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4288427-A1 GPR84 ANTAGONISTS AND USES THEREOF Liminal Biosciences Limited (GB) 2023-12-13 EP disclosed
CN-117098757-A GPR84 antagonists and uses thereof 里米诺生物科学有限公司 2023-11-21 CN disclosed
WO-2022167457-A1 GPR84 ANTAGONISTS AND USES THEREOF Liminal Biosciences Limited (GB) 2022-08-11 WO disclosed
WO-2016007736-A1 IMIDAZOPYRAZINES AS LSD1 INHIBITORS INCYTE CORPORATION (US) 2016-01-14 WO disclosed
WO-2014138616-A2 PYRAZOLE COMPOUNDS AND METHODS OF USE THEREOF TRANSLATIONAL DRUG DEVELOPMENT, LLC (US) 2014-09-12 WO disclosed
EP-2260032-A2 FUNGICIDAL HETERCYCLIC COMPOUNDS E. I. du Pont de Nemours and Company (US) 2010-12-15 EP disclosed
WO-2009094445-A2 FUNGICIDAL HETERCYCLIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-07-30 WO disclosed