SCHEMBL2919386

SCHEMBL2919386

COC(=O)c1[nH]c(Br)c(Br)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 3/20 0.38
RAB9A P51151 3/20 0.37
NPC1 O15118 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
XDH P47989 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 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
SCHEMBL14011276 0.84 NPSR1 (0.50) L3MBTL1TSHRNPSR1LMNARAB9A
SCHEMBL30483935 0.78 NPSR1 (0.50) L3MBTL1TSHRNPSR1LMNARAB9A
SCHEMBL2915910 0.77 GPR35 (0.46) L3MBTL1TSHRNPSR1LMNACYP1A2
SCHEMBL30725399 0.74 KDM4C (0.38) L3MBTL1TSHRNPSR1CYP1A2XDH
SCHEMBL9826778 0.73 ULK1 (0.35) TSHRNPSR1CCNCCDK8KDM4C
SCHEMBL12531935 0.72 CYP1A2 (0.64) L3MBTL1TSHRNPSR1LMNARAB9A
SCHEMBL16237134 0.71 NR4A2 (0.39) L3MBTL1TSHRNPSR1LMNAXDH
SCHEMBL25246503 0.70 ALDH1A1 (0.42) L3MBTL1TSHRNPSR1LMNARAB9A
SCHEMBL7256405 0.69 NPSR1 (0.79) L3MBTL1TSHRNPSR1LMNARAB9A
SCHEMBL14129601 0.68 NPSR1 (0.50) L3MBTL1TSHRNPSR1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2224809-A1 INHIBITION OF BIOFILMS IN PLANTS WITH IMIDAZOLE DERIVATIVES North Carolina State University (US) 2010-09-08 EP disclosed
WO-2009070304-A1 INHIBITION OF BIOFILMS IN PLANTS WITH IMIDAZOLE DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2009-06-04 WO disclosed
EP-2053920-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE DERIVATIVES North Carolina State University (US) 2009-05-06 EP disclosed
WO-2008094479-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-07 WO disclosed