SCHEMBL17183142

SCHEMBL17183142

O=C(c1ccccc1)c1ccc(CCCCCCCl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.54
PPARG P37231 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
MAPT P10636 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HDAC8 Q9BY41 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SRD5A2 P31213 2/20 0.47
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL17183161 0.93 PPARG (0.52) HDAC1PPARGALDH1A1HDAC8NPC1
Ammonia Solution, Strong SCHEMBL29011195 0.91 PPARG (0.51) HDAC1PPARGMAPTALDH1A1HDAC8
SCHEMBL28251464 0.91 HDAC1 (0.62) HDAC1PPARGMAPTRXFP1ALDH1A1
SCHEMBL9148266 0.86 HDAC1 (0.50) HDAC1THRATHRBMAPTALDH1A1
SCHEMBL14244548 0.85 THRA (0.49) HDAC1PPARGTHRATHRBMAPT
Benzophenone SCHEMBL31125347 0.85 ALDH1A1 (0.67) MAPTALDH1A1NPC1RAB9ATDP1
SCHEMBL14772981 0.84 CYP4A11 (0.56) HDAC1PPARGMAPTRXFP1ALDH1A1
SCHEMBL17183151 0.84 HDAC1 (0.56) HDAC1PPARGTHRATHRBMAPT
SCHEMBL31213309 0.84 RARB (0.62) HDAC1THRATHRBMAPTALDH1A1
SCHEMBL31213311 0.84 RARB (0.62) HDAC1THRATHRBMAPTALDH1A1

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
US-10961401-B2 UV cured benzophenone terminated quaternary ammonium antimicrobials for surfaces NANO SAFE COATINGS INCORPORATED (US) 2021-03-30 US disclosed
EP-2931702-B1 UV CURED BENZOPHENONE TERMINATED QUATERNARY AMMONIUM ANTIMICROBIALS FOR SURFACES NANO SAFE COATINGS INCORPORATED (US) 2019-02-20 EP disclosed
US-20180127598-A1 UV CURED BENZOPHENONE TERMINATED QUATERNARY AMMONIUM ANTIMICROBIALS FOR SURFACES NANO SAFE COATINGS, LLC 2018-05-10 US disclosed
US-20150299475-A1 UV CURED BENZOPHENONE TERMINATED QUARTERNARY AMMONIUM ANTIMICROBIALS FOR SURFACES BIOSHIELD TECHNOLOGIES CANADA LIMITED (CA) 2015-10-22 US 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 (3 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-10961401-B2 UV cured benzophenone terminated quaternary ammonium antimicrobials for surfaces AAAS, UBE2M, UBE2I HDAC1 247/4885PPARG 2784/4885THRA 4547/4885
US-20150299475-A1 UV CURED BENZOPHENONE TERMINATED QUARTERNARY AMMONIUM ANTIMICROBIALS FOR SURFACES UBE2I, PHB1, AAAS HDAC1 328/4885PPARG 3355/4885THRA 4634/4885
US-20180127598-A1 UV CURED BENZOPHENONE TERMINATED QUATERNARY AMMONIUM ANTIMICROBIALS FOR SURFACES AAAS, UBE2M, UBE2I HDAC1 247/4885PPARG 2784/4885THRA 4547/4885

“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.