SCHEMBL7029795

SCHEMBL7029795

O=C1c2cccc(Cl)c2Cc2cccc(Cl)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 2/20 0.40
ADORA2A P29274 1/20 0.40
AHR P35869 1/20 0.40
MAOA P21397 1/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
USP2 O75604 1/20 0.39
HPN P05981 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX5 P09917 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
PTGS1 P23219 1/20 0.39
PDE4A P27815 1/20 0.39
KDR P35968 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL6902816 0.84 MAOA (0.61) NSD2ADORA2AAHRMAOAMEN1
SCHEMBL9270180 0.84 MAOA (0.61) AHRMAOAMEN1ALDH1A1MAPT
SCHEMBL29522447 0.84 MAOA (0.61) NSD2ADORA2AAHRMAOAMEN1
SCHEMBL10692508 0.83 KDM4E (0.47) MEN1ALDH1A1MAPTKMT2AUSP2
SCHEMBL9272968 0.81 CES1 (0.44) NSD2AHRMAOAMEN1ALDH1A1
SCHEMBL7103871 0.81 TSHR (0.57) NSD2AHRMAOAMEN1ALDH1A1
Anthracene SCHEMBL28843478 0.77 MAOA (0.52) ADORA2AMAOAMEN1ALDH1A1MAPT
SCHEMBL3903366 0.77 ADORA2A (0.36) NSD2ADORA2AAHRMAOAMEN1
SCHEMBL11695787 0.76 TRPV1 (0.40) MAOA
SCHEMBL29394156 0.75 PNMT (0.53) MAOAALDH1A1MAPTTSHRCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596774-B1 For their ability to inhibit the growth of human oral epidermoid carcinoma cells, human cervical carcinoma cells and Chinese hamster ovary cells NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-22 US claimed
US-20030135060-A1 Synthesis, lipid peroxidation and cytotoxic evaluation of 10-substituted 1,5-dichloro-9(10H)-anthracenone derivatives NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-17 US claimed
US-6369246-B2 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, ANTITUMOR AGENTS DR. KEITH CHAN, GLOBOASIA, LLC 2002-04-09 US claimed
US-20010018539-A1 Synthesis and pharmaceuticals of novel 9-substituted-1, 5-dichloroanthracene analogs CHAN, KEITH 2001-08-30 US claimed
WO-2000061536-A2 SYNTHESIS AND PHARMACEUTICALS OF NOVEL 9-SUBSTITUTED-1,5-DICHLOROANTHRACENE ANALOGS GLOBOASIA, L.L.C. (US) 2000-10-19 WO claimed
US-6596774-B1 For their ability to inhibit the growth of human oral epidermoid carcinoma cells, human cervical carcinoma cells and Chinese hamster ovary cells NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-22 US disclosed
US-6596774-B1 For their ability to inhibit the growth of human oral epidermoid carcinoma cells, human cervical carcinoma cells and Chinese hamster ovary cells NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-22 US disclosed
US-20030135060-A1 Synthesis, lipid peroxidation and cytotoxic evaluation of 10-substituted 1,5-dichloro-9(10H)-anthracenone derivatives NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-17 US disclosed
US-20030135060-A1 Synthesis, lipid peroxidation and cytotoxic evaluation of 10-substituted 1,5-dichloro-9(10H)-anthracenone derivatives NATIONAL SCIENCE COUNCIL OF R.O.C. (TW) 2003-07-17 US disclosed
US-6369246-B2 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, ANTITUMOR AGENTS DR. KEITH CHAN, GLOBOASIA, LLC 2002-04-09 US disclosed
US-20010018539-A1 Synthesis and pharmaceuticals of novel 9-substituted-1, 5-dichloroanthracene analogs CHAN, KEITH 2001-08-30 US disclosed
WO-2000061536-A2 SYNTHESIS AND PHARMACEUTICALS OF NOVEL 9-SUBSTITUTED-1,5-DICHLOROANTHRACENE ANALOGS GLOBOASIA, L.L.C. (US) 2000-10-19 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-20030135060-A1 Synthesis, lipid peroxidation and cytotoxic evaluation of 10-substituted 1,5-dichloro-9(10H)-anthracenone derivatives GPX4, GPX1, AGK NSD2 3492/4885ADORA2A 1702/4885AHR 3115/4885
US-20010018539-A1 Synthesis and pharmaceuticals of novel 9-substituted-1, 5-dichloroanthracene analogs C3AR1, C5AR2, TLR2 NSD2 3252/4885ADORA2A 984/4885AHR 4/4885

“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.