SCHEMBL4056957

SCHEMBL4056957

CCCCCc1ccc(C(N)=O)c(-c2ccccc2-c2cnc(N)[nH]2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 8/20 0.42
PPARG P37231 4/20 0.40
PPARA Q07869 2/20 0.39
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39
S1PR4 O95977 2/20 0.38
S1PR1 P21453 2/20 0.38
S1PR5 Q9H228 2/20 0.38
S1PR3 Q99500 1/20 0.38
FAAH O00519 1/20 0.37
KAT8 Q9H7Z6 2/20 0.36

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
Hydrochloric Acid SCHEMBL4297887 0.99 BRS3 (0.42) BRS3PPARGPPARAPLA2G10PLA2G2A
SCHEMBL4057258 0.86 PLA2G2A (0.46) BRS3PPARGPPARAPLA2G10PLA2G2A
Hydrochloric Acid SCHEMBL4303742 0.85 PLA2G2A (0.45) BRS3PPARGPPARAPLA2G10PLA2G2A
SCHEMBL4057252 0.79 TLR8 (0.37) BRS3
Hydrochloric Acid SCHEMBL4303739 0.78 TLR8 (0.36) BRS3
SCHEMBL4064876 0.75 MASP2 (0.50)
SCHEMBL4056960 0.74 PLK1 (0.54)
Hydrochloric Acid SCHEMBL4302259 0.74 MASP2 (0.49)
Hydrochloric Acid SCHEMBL4297888 0.73 PLK1 (0.53)
SCHEMBL28826023 0.70 KAT8 (0.58) PPARGPPARAKAT8

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-9975857-B2 Inhibition of bacterial biofilms with imidazole-phenyl derivatives NORTH CAROLINA STATE UNIVERSITY (US) 2018-05-22 US disclosed
US-20150183746-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES UNIV NORTH CAROLINA STATE (US) 2015-07-02 US disclosed
US-9005643-B2 Inhibition of bacterial biofilms with imidazole-phenyl derivatives NORTH CAROLINA STATE UNIVERSITY (US) 2015-04-14 US disclosed
US-20090270475-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2009-10-29 US disclosed
WO-2009123753-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2009-10-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090270475-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES TFPI, O60361, PGLS BRS3 4220/4885PPARG 2275/4885PPARA 2155/4885
US-20150183746-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES TFPI, O60361, PGLS BRS3 4220/4885PPARG 2275/4885PPARA 2155/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.