SCHEMBL9228703

SCHEMBL9228703

CC(C)(C)Nc1ccc(S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.54
▸ KMT2A Q03164 6/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ TSHR P16473 2/20 0.53
▸ ABCC9 O60706 1/20 0.53
▸ ABCC8 Q09428 1/20 0.53
▸ KCNJ11 Q14654 1/20 0.53
▸ KCNJ8 Q15842 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ MAPT P10636 5/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ HPGD P15428 3/20 0.49
▸ HSD11B1 P28845 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ PRMT1 Q99873 2/20 0.47

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
Hydrochloric Acid SCHEMBL9231987 0.98 HTR6 (0.52) HTR6KMT2AMEN1TSHRABCC9
SCHEMBL13884294 0.92 ALDH1A1 (0.55) HTR6KMT2AMEN1TSHRABCC9
SCHEMBL9230987 0.85 GAA (0.61) KMT2AMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL9229082 0.83 MAPT (0.47) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL9230339 0.83 HTR6 (0.59) HTR6KMT2AMEN1TSHRCYP1A2
SCHEMBL9228707 0.82 ABCC9 (0.60) KMT2AMEN1ABCC9ABCC8KCNJ11
SCHEMBL13945783 0.81 MEN1 (0.67) HTR6KMT2AMEN1CYP3A4MAPT
SCHEMBL9232591 0.81 HSD11B1 (0.64) HTR6ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL9228688 0.80 ALDH1A1 (0.65) KMT2AMEN1CYP2C19MAPTALDH1A1
SCHEMBL9232433 0.80 PKM (0.66) MAPTALDH1A1HSD11B1LMNAMAPK1

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
EP-0666253-A1 N-t-BUTYLANILINE ANALOG AND LIPID LEVEL DEPRESSANT CONTAINING THE SAME TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-08-09 — — EP claimed
US-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-05 — — US disclosed
US-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-05 — — US disclosed
EP-0666253-A1 N-t-BUTYLANILINE ANALOG AND LIPID LEVEL DEPRESSANT CONTAINING THE SAME TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-08-09 — — EP 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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CYP3A5, CYP11B2, ABCB1 HTR6 408/4885KMT2A 2489/4885MEN1 3723/4885

“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.

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