SCHEMBL8549332

SCHEMBL8549332

CC(Br)C(=O)c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA7 P43166 2/20 0.35
CA13 Q8N1Q1 2/20 0.35
CA14 Q9ULX7 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
CISD1 Q9NZ45 1/20 0.35
TSHR P16473 5/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 1/20 0.35
HIF1A Q16665 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL5453166 0.88 LMNA (0.40) CA12CA1CA2CA9CA3
SCHEMBL27351373 0.82 SLC9A1 (0.42) ALDH1A1CYP3A4L3MBTL1CYP1A2CYP2C9
SCHEMBL8545974 0.82 ALDH1A1 (0.44) TSHRALDH1A1SMN1; SMN2GAAHPGD
SCHEMBL3141276 0.79 ALDH1A1 (0.55) CA1CA2TSHRALDH1A1CYP3A4
SCHEMBL29712852 0.79 ALDH1A1 (0.55) CA1CA2TSHRALDH1A1CYP3A4
SCHEMBL1922201 0.79 SMN1; SMN2 (0.55) TSHRALDH1A1CYP3A4HIF1ATDP1
SCHEMBL13401662 0.78 TSHR (0.39) CA12CA1CA2CA9CA3
SCHEMBL8393015 0.77 HPGD (0.45) ALDH1A1SMN1; SMN2HPGD
SCHEMBL1922910 0.77 MAPK1 (0.46) TSHRALDH1A1L3MBTL1CYP1A2HPGD
SCHEMBL8550522 0.76 MAP2K1 (0.40) TSHRALDH1A1HIF1ATDP1L3MBTL1

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
US-5821255-A REGULATING THE SECRETION OF CORTICOTROPIN, BETA-ENDORPHIN OR PEPTIDES DERIVED FROM PROOPIOMELANOCORTIN SANOFI (FR) 1998-10-13 US disclosed
EP-0659747-B1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-04-01 EP disclosed
US-5602132-A USEFUL IN TREATMENT OF PATHOLOGIES INVOLVING CORTICOTROPIN RELEASING FACTOR SANOFI (FR) 1997-02-11 US disclosed
CN-1127252-A Branched-amino-sbustituted thiazoles, processes for their preparation and the pharmaceutical compositions which contain them SANOFI SA (FR) 1996-07-24 CN disclosed
EP-0659747-A1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-06-28 EP disclosed