SCHEMBL12119339

SCHEMBL12119339

Cc1cc(C)cc(S(=O)(=O)Nc2ccc3c(C(=O)NCc4ccccc4)cccc3c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.48
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ HDAC3 O15379 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45
▸ HDAC11 Q96DB2 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ HDAC9 Q9UKV0 1/20 0.45
▸ HDAC5 Q9UQL6 1/20 0.45
▸ NSD2 O96028 2/20 0.45
▸ KCNA5 P22460 1/20 0.44
▸ FPR1 P21462 1/20 0.44
▸ POLB P06746 2/20 0.44
▸ TP53 P04637 1/20 0.44

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
SCHEMBL1320525 0.88 KCNA5 (0.52) MAPTMEN1KMT2AALDH1A1HDAC3
SCHEMBL4245444 0.86 TUBB (0.49) MAPTMEN1KMT2AHDAC3HDAC4
SCHEMBL2055414 0.86 PLK1 (0.49) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL3270506 0.84 CYP2C9 (0.51) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL1320740 0.82 KMT2A (0.53) MAPTMEN1KMT2AALDH1A1HDAC3
SCHEMBL13905620 0.81 TUBB (0.48) MAPTMEN1KMT2AHDAC3HDAC4
SCHEMBL12119507 0.81 CYP2C9 (0.50) MAPTMEN1KMT2AHDAC3HDAC4
SCHEMBL1110328 0.79 NAMPT (0.55) ALDH1A1KCNA5NAMPT
SCHEMBL1110231 0.78 HIF1A (0.45) MAPTMEN1KMT2AALDH1A1HDAC3
SCHEMBL12119237 0.78 KEAP1 (0.47) MAPTALDH1A1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 — — US disclosed
WO-2009127723-A1 NEW ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-10-22 — — 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-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS SULT2A1, UGT1A1, SLC5A1 MAPT 4383/4885MEN1 3970/4885KMT2A 645/4885

“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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