SCHEMBL5031992

SCHEMBL5031992

CC(C)S(=O)(=O)CN(C(=O)O)C1CCC(n2nnnc2C(F)(F)F)CC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD11B1 P28845 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL5031989 0.74 CCR2 (0.34) LMNAMEN1KMT2A
SCHEMBL1973469 0.72 MEN1 (0.38) LMNAMEN1KMT2AHSD11B1L3MBTL1
SCHEMBL1973468 0.72 MEN1 (0.38) LMNAMEN1KMT2AHSD11B1L3MBTL1
SCHEMBL5029421 0.72 ALDH1A1 (0.30) ALDH1A1
SCHEMBL12513277 0.71 MEN1 (0.37) LMNAMEN1KMT2AHSD11B1L3MBTL1
SCHEMBL22721991 0.71 MEN1 (0.37) LMNAMEN1KMT2AHSD11B1L3MBTL1
SCHEMBL22722020 0.71 MEN1 (0.37) LMNAMEN1KMT2AHSD11B1L3MBTL1
SCHEMBL5033604 0.69
SCHEMBL22722036 0.68 MEN1 (0.41) MEN1KMT2AALDH1A1
SCHEMBL5029177 0.68 SMYD3 (0.31)

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-7378409-B2 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 US disclosed
US-20050054626-A1 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY 2005-03-10 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 (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-20050054626-A1 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity CCL11, CCR1, CCR2 LMNA 4639/4885MEN1 3483/4885KMT2A 4093/4885

“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.