SCHEMBL4057258

SCHEMBL4057258

CCCCCc1ccc(C(N)=O)c(-c2cccc(-c3cnc(N)[nH]3)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 10/20 0.46
PLA2G10 O15496 9/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.43
S1PR4 O95977 3/20 0.41
S1PR1 P21453 3/20 0.41
S1PR5 Q9H228 3/20 0.41
S1PR3 Q99500 2/20 0.41
SCN9A Q15858 2/20 0.39
PLA2G1B P04054 1/20 0.39
PLA2G5 P39877 1/20 0.39
PLA2G2C Q5R387 1/20 0.39
PLA2G12B Q9BX93 1/20 0.39
PLA2G12A Q9BZM1 1/20 0.39
PLA2G2F Q9BZM2 1/20 0.39
PLA2G3 Q9NZ20 1/20 0.39
PLA2G2E Q9NZK7 1/20 0.39
PLA2G2D Q9UNK4 1/20 0.39
MASP2 O00187 1/20 0.38
SCN4A P35499 1/20 0.38
SCN3A Q9NY46 1/20 0.38

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 SCHEMBL4303742 0.99 PLA2G2A (0.45) PLA2G2APLA2G10SLCO1B1S1PR4S1PR1
SCHEMBL4056957 0.86 BRS3 (0.42) PLA2G2APLA2G10S1PR4S1PR1S1PR5
Hydrochloric Acid SCHEMBL4297887 0.85 BRS3 (0.42) PLA2G2APLA2G10S1PR4S1PR1S1PR5
SCHEMBL4057257 0.75 TRPV1 (0.55) SCN9ASCN4ASCN3A
SCHEMBL13655379 0.74 TRPV1 (0.56) SCN9ASCN4ASCN3A
Hydrochloric Acid SCHEMBL4303740 0.74 TRPV1 (0.54) SCN9ASCN4ASCN3A
SCHEMBL20500986 0.73 MEN1 (0.54) SCN9ASCN4ASCN3A
SCHEMBL20501151 0.71 SCN4A (0.44) S1PR4S1PR1S1PR5S1PR3SCN9A
SCHEMBL4063091 0.69 MASP2 (0.56) SCN9AMASP2SCN4ASCN3A
SCHEMBL13655270 0.69 ABL1 (0.52) SCN9ASCN4ASCN3A

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 PLA2G2A 3950/4885PLA2G10 4124/4885SLCO1B1 3603/4885
US-20150183746-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES TFPI, O60361, PGLS PLA2G2A 3950/4885PLA2G10 4124/4885SLCO1B1 3603/4885

“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.