SCHEMBL7186960

SCHEMBL7186960

CCCCCOc1c2cccc(Cl)c2cc2cccc(Cl)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.37
CNR2 P34972 4/20 0.37
KCNH2 Q12809 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2A6 P11509 1/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NR4A2 P43354 1/20 0.36
APP P05067 1/20 0.35
BACE1 P56817 1/20 0.35
MCHR1 Q99705 2/20 0.35
TLR8 Q9NR97 2/20 0.35
HTR1B P28222 1/20 0.35
GPBAR1 Q8TDU6 1/20 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
SCHEMBL9484855 0.87 TSHR (0.36) CNR1CNR2KCNH2TSHRKMT2A
SCHEMBL5680093 0.87 TSHR (0.41) KCNH2TSHRKMT2AAPPBACE1
SCHEMBL20414593 0.73 L3MBTL1 (0.51) TSHRMEN1CYP3A4KMT2AMCHR1
SCHEMBL19612195 0.72 TLR8 (0.43) CNR1CNR2KCNH2CYP2C9TSHR
SCHEMBL28698562 0.72 CNR1 (0.47) CNR1CNR2CYP2C9MEN1CYP3A4
SCHEMBL27603617 0.72 CNR1 (0.41) CNR1CNR2CYP2C9TSHRCYP1A2
SCHEMBL7712652 0.71 MAPT (0.46) TSHRCYP1A2CYP2A6MEN1TP53
SCHEMBL28371895 0.71 HTR1B (0.46) CNR1CNR2CYP2C9MCHR1TLR8
SCHEMBL20678383 0.71 MCHR1 (0.47) CNR1CNR2KCNH2CYP2C9TSHR
SCHEMBL600606 0.71 LTA4H (0.52) CNR1CNR2CYP2C9TSHRCYP1A2

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 7 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 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-A3 SYNTHESIS AND PHARMACEUTICALS OF NOVEL 9-SUBSTITUTED-1,5-DICHLOROANTHRACENE ANALOGS GLOBOASIA L L C (US) 2001-04-26 WO 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
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 CNR1 1223/4885CNR2 2275/4885KCNH2 2329/4885
US-20010018539-A1 Synthesis and pharmaceuticals of novel 9-substituted-1, 5-dichloroanthracene analogs C3AR1, C5AR2, TLR2 CNR1 102/4885CNR2 47/4885KCNH2 1495/4885

“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.