SCHEMBL13655241

SCHEMBL13655241

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncc(-c2ccc(NC(=O)c3cc(F)cc(F)c3)cc2)n1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PTPN1 P18031 3/20 0.36
PTPN6 P29350 2/20 0.36
PTPN11 Q06124 1/20 0.36
DGAT1 O75907 1/20 0.36
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
LMNA P02545 1/20 0.35
IDO1 P14902 1/20 0.35
NAMPT P43490 1/20 0.35
ABCB1 P08183 1/20 0.35
ABCC1 P33527 1/20 0.35
AURKA O14965 1/20 0.35
AURKB Q96GD4 1/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
NR1H2 P55055 2/20 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
SCHEMBL13663132 0.81 PTPN1 (0.53) NPC1RAB9APTPN1PTPN6MAPT
SCHEMBL13655215 0.81 TRPV1 (0.43) NPC1RAB9ANR1H2
SCHEMBL13655220 0.79 HDAC8 (0.43) SMN1; SMN2PTPN1PTPN6MAPTMEN1
SCHEMBL24176651 0.78 NR1H2 (0.38) AURKANR1H2
SCHEMBL16866190 0.77 WNT3A (0.42) NPC1LMNAMEN1KMT2ANR1H2
SCHEMBL4057049 0.77 RAB9A (0.38) SMN1; SMN2NPC1RAB9AMAPTTP53
SCHEMBL24176646 0.77 HDAC2 (0.35) SMN1; SMN2NPC1RAB9ATP53NR1H2
SCHEMBL13663133 0.76 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AMAPTTP53
SCHEMBL4238357 0.75 SCN3A (0.48)
SCHEMBL10117875 0.74 NPC1 (0.35) SMN1; SMN2NPC1RAB9AIDO1MEN1

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 8 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-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-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
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 SMN1; SMN2 4885/4885NPC1 4225/4885RAB9A 1842/4885
US-20150183746-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES TFPI, O60361, PGLS SMN1; SMN2 4885/4885NPC1 4225/4885RAB9A 1842/4885

“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.