SCHEMBL6712175

SCHEMBL6712175

CC(C)(C)OC(=O)N1CCCC(C(=O)Nc2ccccc2Oc2ccccc2)C1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
PKM P14618 1/20 0.61
TSHR P16473 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.49
RHOA P61586 1/20 0.48
USP30 Q70CQ3 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.47
ABL1 P00519 1/20 0.47
RIN1 Q13671 1/20 0.47
ACHE P22303 1/20 0.47
BACE1 P56817 1/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL4101109 0.84 KMT2A (0.57) GAASMN1; SMN2MAPTUSP30KMT2A
SCHEMBL19378084 0.83 HDAC1 (0.62) GAATSHRSMN1; SMN2MAPTUSP30
SCHEMBL5871130 0.83 KMT2A (0.60) GAATSHRSMN1; SMN2MAPTPOLB
SCHEMBL17533942 0.83 HDAC1 (0.62) GAATSHRSMN1; SMN2MAPTUSP30
SCHEMBL3739365 0.83 PARP1 (0.53) GAATSHRSMN1; SMN2MAPTUSP30
SCHEMBL762580 0.83 HDAC1 (0.62) GAATSHRSMN1; SMN2MAPTUSP30
SCHEMBL3715390 0.83 ABL1 (0.62) GAASMN1; SMN2MAPTPOLBUSP30
SCHEMBL5870918 0.83 ABL1 (0.62) GAASMN1; SMN2MAPTPOLBUSP30
SCHEMBL1868663 0.82 TSHR (0.57) GAATSHRMAPTPOLBKMT2A
SCHEMBL3881644 0.82 TSHR (0.57) GAATSHRMAPTPOLBKMT2A

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
US-20040235832-A1 ANTIPSYCHOTIC SULFONAMIDE-HETEROCYCLES, AND METHODS OF USE THEREOF WU XINHE (US) 2004-11-25 US disclosed
US-6703383-B2 HETEROCYCLIC COMPOUNDS COMPRISING A SULFONAMIDE GROUP TO TREAT DISEASES SUCH AS PSYCHOLOGICAL DISORDERS CAUSED BY ONE OR MORE PROTEIN-G COUPLED RECEPTORS OR LIGAND -GATED ION CHANNELS SEPRACOR, INC. 2004-03-09 US disclosed
US-20020065265-A1 Antipsychotic sulfonamide-heterocycles, and methods of use thereof SEPRACOR INC. 2002-05-30 US disclosed
WO-2002022579-A2 ANTIPSYCHOTIC SULFONAMIDE-HETEROCYCLES, AND METHODS OF USE THEREOF SEPRACOR, INC. (US) 2002-03-21 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-20020065265-A1 Antipsychotic sulfonamide-heterocycles, and methods of use thereof TRPV1, CNR2, TRPM5 GAA 3079/4885PKM 2604/4885TSHR 449/4885
US-20040235832-A1 ANTIPSYCHOTIC SULFONAMIDE-HETEROCYCLES, AND METHODS OF USE THEREOF TRPV1, CNR2, TRPM5 GAA 3079/4885PKM 2604/4885TSHR 449/4885

“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.