SCHEMBL6678633

SCHEMBL6678633

CN(C)c1ccc(NS(=O)(=O)c2ccc(Cl)c(C#N)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
TDP1 Q9NUW8 3/20 0.60
MAPT P10636 5/20 0.59
LMNA P02545 2/20 0.59
HTT P42858 1/20 0.55
GFER P55789 2/20 0.55
MAPK1 P28482 1/20 0.55
MCL1 Q07820 1/20 0.55
SLC22A12 Q96S37 5/20 0.51
ACLY P53396 2/20 0.48
PLA2G7 Q13093 2/20 0.47
BRD4 O60885 1/20 0.46
BRD1 O95696 1/20 0.46
BRPF1 P55201 1/20 0.46
BRD9 Q9H8M2 1/20 0.46
BRPF3 Q9ULD4 1/20 0.46
NPSR1 Q6W5P4 2/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL7540401 0.85 SLC22A12 (0.54) ALDH1A1MAPTLMNAHTTSLC22A12
SCHEMBL6675727 0.85 ALDH1A1 (0.57) ALDH1A1TDP1MAPTLMNAHTT
SCHEMBL6681272 0.85 MAPT (0.55) ALDH1A1TDP1MAPTLMNAHTT
SCHEMBL14018760 0.84 ALDH1A1 (0.70) ALDH1A1TDP1MAPTLMNAHTT
SCHEMBL6674281 0.82 MAPT (0.61) ALDH1A1MAPTLMNAMAPK1SLC22A12
SCHEMBL7537206 0.80 MAPT (0.53) ALDH1A1TDP1MAPTLMNAHTT
SCHEMBL6674394 0.79 SLC22A12 (0.49) ALDH1A1TDP1MAPTLMNAGFER
SCHEMBL6678890 0.78 LMNA (0.67) ALDH1A1MAPTLMNAHTTMAPK1
SCHEMBL6679999 0.77 VCAM1 (0.60) ALDH1A1TDP1MAPTLMNAHTT
SCHEMBL6674454 0.77 TDP1 (0.60) ALDH1A1TDP1MAPTLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US claimed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP claimed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO claimed
EP-1005453-B1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE LOWERING AGENTS TULARIK INC (US) 2004-10-27 EP disclosed
US-6388131-B2 Benzenesulfonamide compounds, which encompasses the compound batabulin (2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene) TULARIK, INC. 2002-05-14 US disclosed
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US disclosed
US-6284923-B1 BENZENESULFONIMIDES FOR TREATMENT OF CANCER AND ANTICHOLESTEROL AGENTS TULARIK INC 2001-09-04 US disclosed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP disclosed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 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 (1 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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 ALDH1A1 1173/4885TDP1 1692/4885MAPT 2283/4885

“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.