SCHEMBL14679133

SCHEMBL14679133

CCCCCCc1ccc(C(=O)CI)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 12/20 0.71
▸ THRB P10828 12/20 0.71
▸ HAO1 Q9UJM8 1/20 0.65
▸ RARB P10826 5/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ RARA P10276 1/20 0.61
▸ MAPT P10636 1/20 0.61
▸ MTOR P42345 1/20 0.61

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
SCHEMBL14679132 0.93 THRA (0.60) THRATHRBHAO1RARBMEN1
SCHEMBL11715472 0.88 THRA (0.73) THRATHRBHAO1RARBMEN1
SCHEMBL13267849 0.86 THRA (0.75) THRATHRBHAO1RARBMEN1
SCHEMBL1577439 0.86 HAO1 (0.79) THRATHRBHAO1RARBMEN1
SCHEMBL8903148 0.86 THRA (0.75) THRATHRBHAO1RARBMEN1
SCHEMBL11435461 0.86 THRA (0.75) THRATHRBHAO1RARBMEN1
SCHEMBL10883866 0.86 THRA (0.75) THRATHRBHAO1RARBMEN1
SCHEMBL11427685 0.86 THRA (0.75) THRATHRBHAO1RARBMEN1
SCHEMBL15960542 0.84 THRA (0.79) THRATHRBHAO1RARBMEN1
SCHEMBL11715480 0.84 THRA (0.73) THRATHRBHAO1RARBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367713-B2 Inhibition and dispersion of bacterial biofilms with imidazole-triazole derivatives NORTH CAROLINA STATE UNIVERSITY (US) 2013-02-05 — — US disclosed
Send feedback