SCHEMBL15968613

SCHEMBL15968613

COC(=O)c1cccc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
CYP1A2 P05177 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPK1 P28482 1/20 0.36
ATR Q13535 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GRM5 P41594 1/20 0.36
SYK P43405 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL29988409 1.00 MAPT (0.42) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL29235433 0.88 MAPT (0.36) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL19583660 0.86 MAPT (0.40) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL13447982 0.85 KDM4E (0.47) NPC1RAB9AGAASYKKDM4E
SCHEMBL465913 0.85 CYP1A2 (0.59) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL4042974 0.83 PTGER1 (0.33) CYP1A2CYP2C9CYP2C19SYK
SCHEMBL29708646 0.81 GRM5 (0.41) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL18555244 0.81 MAPT (0.33) MAPTCYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL14551211 0.80 RAB9A (0.37) MAPTSMN1; SMN2NPC1RAB9AMAPK1
SCHEMBL943797 0.79 SSTR4 (0.37) NPC1RAB9AGAAGRM5SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763976-B1 2-PYRIDYL CARBOXAMIDE-CONTAINING SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2016-05-18 EP disclosed
US-9216173-B2 2-Pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-22 US disclosed
US-20140243336-A1 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors MERCK SHARP & DOHME LLC 2014-08-28 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-20140243336-A1 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors SYK, BTK, LCK MAPT 3752/4885CYP1A2 1640/4885SMN1; SMN2 3399/4885

“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.