SCHEMBL5437706

SCHEMBL5437706

CC(C)C[C@H](N)C(=O)N(CCCNS(=O)(=O)c1ccc(F)cc1Cl)C(=O)CC1C[C@@H]2CC[C@H]1C2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HSD11B1 P28845 2/20 0.35
CCR1 P32246 1/20 0.35
BMP1 P13497 1/20 0.34
ADAM17 P78536 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
SCN9A Q15858 2/20 0.33
KCNA5 P22460 1/20 0.33
BRD4 O60885 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
EPHX2 P34913 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5437700 0.78 MEN1 (0.45) KMT2AMEN1HSD11B1CCR1BMP1
SCHEMBL5434633 0.76 TRPV4 (0.42) KMT2ACCR1BMP1ADAM17TRPV4
SCHEMBL4142306 0.75 BMP1 (0.37) KMT2AMEN1CCR1BMP1ADAM17
SCHEMBL5439595 0.72 CNR2 (0.37) HSD11B1EPHX2
SCHEMBL4147711 0.72 TRPV4 (0.39) KMT2AMEN1CCR1TRPV4KCNA5
SCHEMBL5429673 0.72 CNR2 (0.36) HSD11B1EPHX2
SCHEMBL4140789 0.71 TRPV4 (0.38) KMT2AMEN1CCR1TRPV4
SCHEMBL5429196 0.71 CCR1 (0.40) HSD11B1CCR1BMP1ADAM17TRPV4
SCHEMBL4139936 0.70 CNR2 (0.37) HSD11B1EPHX2
SCHEMBL4140796 0.70 CNR2 (0.36) HSD11B1EPHX2

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-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor SMITHKLINE BEECHAM CORPORATION 2007-11-08 US claimed
US-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor SMITHKLINE BEECHAM CORPORATION 2007-11-08 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-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor TRPV4, TRPC4, TRPV1 KMT2A 3582/4885MEN1 1683/4885HSD11B1 1641/4885

“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.