SCHEMBL3244593

SCHEMBL3244593

O=CC(Br)c1ccc(OC(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.50
ALDH1A1 P00352 5/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ATM Q13315 2/20 0.41
ALOX15 P16050 2/20 0.41
PKM P14618 2/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
HSP90AA1 P07900 1/20 0.41
HPGD P15428 1/20 0.41
CCR6 P51684 1/20 0.41
GFER P55789 1/20 0.41
ADAM17 P78536 1/20 0.41
MAPT P10636 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
DAO P14920 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 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
SCHEMBL7512548 0.81 ALDH1A3 (0.55) ALDH1A1KMT2AMEN1POLBNPSR1
SCHEMBL6988479 0.79 DRD1 (0.49) DRD1KMT2AMEN1ATMLMNA
SCHEMBL21988008 0.78 DRD1 (0.52) DRD1ALDH1A1KMT2AMEN1ATM
SCHEMBL24492651 0.78 MEN1 (0.42) DRD1ALDH1A1KMT2AMEN1ATM
SCHEMBL1155920 0.76 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1PKMRAB9A
SCHEMBL1128044 0.76 PDE2A (0.42) ALDH1A1KMT2AMEN1MAPTNPC1
SCHEMBL21497149 0.76 PDE2A (0.42) ALDH1A1KMT2AMEN1MAPTNPC1
SCHEMBL5481298 0.76 SOS1 (0.42) ALDH1A1LMNAL3MBTL1
SCHEMBL9570593 0.74 DRD1 (0.47) DRD1ALDH1A1KMT2AMEN1ATM
SCHEMBL6120912 0.74 RXRA (0.34) DRD1

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-2885306-A1 IMIDAZO[2,1]THIAZOL-3-ONE DERIVATIVES USEFUL AS DIAGNOSTIC AGENTS FOR ALZHEIMER'S DISEASE F. Hoffmann-La Roche AG (CH) 2015-06-24 EP disclosed
WO-2014026881-A1 IMIDAZO[2,1]THIAZOL-3-ONE DERIVATIVES USEFUL AS DIAGNOSTIC AGENTS FOR ALZHEIMER'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2014-02-20 WO disclosed
EP-2265606-A1 HEPATITIS C VIRUS INHIBITORS Bristol-Myers Squibb Company (US) 2010-12-29 EP disclosed
EP-2190844-A2 IMIDAZO[L,2-a]PYRIDINE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2010-06-02 EP disclosed
WO-2009129109-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-22 WO disclosed
WO-2009023253-A2 IMIDAZO[L,2-α]PYRIDINE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS INC. (US) 2009-02-19 WO disclosed