SCHEMBL9315757

SCHEMBL9315757

Cc1ccc(C(C)(C)C)cc1S(N)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
CA1 P00915 11/20 0.49
CA2 P00918 11/20 0.49
CA9 Q16790 4/20 0.49
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
CA12 O43570 2/20 0.44
BRD4 O60885 1/20 0.44
BRD2 P25440 1/20 0.44
BRD3 Q15059 1/20 0.44
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
MAOB P27338 1/20 0.43
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL15450300 0.86 PDIA6 (0.51) LMNACA1CA2CA9MEN1
SCHEMBL9843456 0.83 LMNA (0.53) LMNACA1CA2CA9MEN1
SCHEMBL18997029 0.82 LMNA (0.51) LMNACA1CA2CA9MEN1
SCHEMBL1523192 0.80 ALDH1A1 (0.52) CA1CA2CA9MEN1KMT2A
SCHEMBL17029240 0.80 ALDH1A1 (0.57) LMNACA1CA2CA9MEN1
SCHEMBL1727029 0.80 LMNA (0.50) LMNACA1CA2CA9MEN1
SCHEMBL27532899 0.80 LMNA (0.54) LMNACA1CA2CA9MEN1
SCHEMBL1806610 0.78 CA1 (0.47) CA1CA2CA9MEN1KMT2A
SCHEMBL1806608 0.78 CA1 (0.47) CA1CA2CA9MEN1KMT2A
SCHEMBL13687109 0.78 CA1 (0.47) CA1CA2CA9MEN1KMT2A

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-20150111885-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2015-04-23 US disclosed
US-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-5358815-A Toner compositions containing negative charge-controlling additive EASTMAN KODAK COMPANY (US) 1994-10-25 US 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-20150111885-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 LMNA 1464/4885CA1 2975/4885CA2 3892/4885
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 LMNA 4466/4885CA1 3378/4885CA2 2487/4885

“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.