SCHEMBL14278294

SCHEMBL14278294

C=C[C@@H]1C[C@]1(C)C(=O)NS(=O)(=O)c1ccccc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 1/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ GAA P10253 1/20 0.34
▸ NR1H4 Q96RI1 1/20 0.34
▸ NPY1R P25929 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA6 P23280 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ NFKBIA P25963 2/20 0.32

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
SCHEMBL14278281 0.86 KMT2A (0.32) CA9LMNACA12CA1CA2
SCHEMBL14277995 0.84 HTR6 (0.37) METAP2LMNACA1CA2KMT2A
SCHEMBL14278280 0.84 CFTR (0.38) KMT2ASLC40A1MEN1
SCHEMBL14364348 0.83 METAP2 (0.35) METAP2CA9LMNAUSP2GAA
SCHEMBL14277994 0.83 SLC40A1 (0.41) CA9LMNACA1CA2KMT2A
SCHEMBL14278276 0.83 HTR6 (0.36) CA9LMNACA12CA1CA2
SCHEMBL14302082 0.82 METAP2 (0.34) METAP2CA9LMNAUSP2GAA
SCHEMBL14135646 0.82 KMT2A (0.46) CA2KMT2ATET3FBXL19CXXC5
SCHEMBL14278003 0.81 CASP1 (0.46) GAA
SCHEMBL14278278 0.81 MAPT (0.40) CA1CA2CYP2C9KMT2ACYP3A4

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-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 — — US disclosed
US-20070265281-A1 Organic Compounds and Their Uses COTTENS SYLVAIN 2007-11-15 — — 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-20080045530-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 METAP2 1061/4885CA9 605/4885LMNA 1174/4885
US-20070265281-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 METAP2 1061/4885CA9 605/4885LMNA 1174/4885

“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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