SCHEMBL20179117

SCHEMBL20179117

CCOC(=O)Cc1ccc(NC(=O)C(C)(C)CC(C)(C)C)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
LMNA P02545 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
PPID Q08752 1/20 0.45
KLK7 P49862 1/20 0.45
CYP4Z1 Q86W10 1/20 0.45
TP53 P04637 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PDK1 Q15118 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK3 Q15120 1/20 0.43
PDK4 Q16654 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL28397907 0.86 MAPT (0.65) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL7422953 0.82 MAPT (0.61) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL8474460 0.82 MAPT (0.60) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL20179213 0.79 HDAC8 (0.46) LMNASMN1; SMN2MEN1HTTKMT2A
SCHEMBL21607160 0.78 L3MBTL1 (0.48) MAPTLMNAMEN1HTTKMT2A
SCHEMBL10685516 0.78 PPID (0.63) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL15709727 0.78 LMNA (0.62) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL14450265 0.77 MAPT (0.60) MAPTLMNASMN1; SMN2MEN1HTT
SCHEMBL68851 0.75 CYP4Z1 (0.62) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL2636023 0.75 MAPT (0.60) MAPTLMNASMN1; SMN2MEN1HTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180141965-A1 AUTOTAXIN INHIBITORS AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2018-05-24 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-20180141965-A1 AUTOTAXIN INHIBITORS AND USES THEREOF ENPP2, SPINT2, SERPINB1 MAPT 2337/4885LMNA 4618/4885SMN1; SMN2 4586/4885

“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.