SCHEMBL14360855

SCHEMBL14360855

CC(C)(C)OC(=O)NCC[C@H](CO)NC(=O)OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.68
MAPT P10636 2/20 0.54
IDO1 P14902 1/20 0.49
CTRB1 P17538 2/20 0.49
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CTSS P25774 2/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
KLK7 P49862 1/20 0.47
KLK5 Q9Y337 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
SLC1A3 P43003 1/20 0.46
SLC1A1 P43005 1/20 0.46
HTT P42858 1/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
PPARA Q07869 1/20 0.45
CTSK P43235 1/20 0.45

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
SCHEMBL6619899 1.00 SYK (0.68) SYKMAPTIDO1CTRB1ATM
SCHEMBL19057326 1.00 SYK (0.68) SYKMAPTIDO1CTRB1ATM
SCHEMBL6620798 0.95 SYK (0.61) SYKMAPTIDO1CTRB1ATM
SCHEMBL6620803 0.95 SYK (0.61) SYKMAPTIDO1CTRB1ATM
SCHEMBL6619895 0.95 SYK (0.61) SYKMAPTIDO1CTRB1ATM
SCHEMBL23161521 0.93 SYK (0.65) SYKMAPTIDO1CTRB1ATM
SCHEMBL2512642 0.93 SYK (0.65) SYKMAPTIDO1CTRB1ATM
SCHEMBL19301063 0.93 SYK (0.65) SYKMAPTIDO1CTRB1ATM
SCHEMBL698615 0.92 SYK (0.64) SYKMAPTKLK7KLK5L3MBTL1
SCHEMBL4103836 0.92 SYK (0.64) SYKMAPTKLK7KLK5L3MBTL1

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 disclosed
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 SYK 3553/4885MAPT 4350/4885IDO1 769/4885

“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.