SCHEMBL16000482

SCHEMBL16000482

CC(C)NC1CCN(C(=O)c2cccc(C(N)=O)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 7/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
EPHX2 P34913 4/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
EPHX1 P07099 2/20 0.48
HPGD P15428 1/20 0.46
PARP10 Q53GL7 2/20 0.46
PARP14 Q460N5 1/20 0.46
MGLL Q99685 1/20 0.46
L3MBTL4 Q8NA19 1/20 0.45
ACHE P22303 1/20 0.44

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
SCHEMBL16002913 0.86 L3MBTL3 (0.53) L3MBTL3L3MBTL1EPHX2EPHX1HPGD
SCHEMBL13826063 0.86 L3MBTL3 (0.51) L3MBTL3L3MBTL1EPHX2MEN1KMT2A
SCHEMBL13825989 0.85 MGLL (0.61) L3MBTL3L3MBTL1MGLL
SCHEMBL13825970 0.84 MGLL (0.60) L3MBTL1MEN1KMT2AMGLL
SCHEMBL13826039 0.83 POLB (0.56) L3MBTL3L3MBTL1EPHX2MEN1KMT2A
SCHEMBL16000493 0.82 LMNA (0.64) L3MBTL3L3MBTL1EPHX2MEN1GAA
SCHEMBL16000516 0.82 L3MBTL1 (0.61) L3MBTL1MEN1GAAHTTKMT2A
Hydrochloric Acid SCHEMBL6276058 0.82 EPHX1 (0.66) L3MBTL3L3MBTL1EPHX2MEN1KMT2A
SCHEMBL16000492 0.81 LMNA (0.66) MEN1KMT2AHPGDMGLL
SCHEMBL13825969 0.81 KMT2A (0.49) L3MBTL3L3MBTL1EPHX2MEN1GAA

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-9145391-B2 Bipyridylaminopyridines as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2015-09-29 US disclosed
US-20140249130-A1 BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2014-09-04 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-20140249130-A1 BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS SYK, BTK, LCK L3MBTL3 4679/4885L3MBTL1 3948/4885EPHX2 1213/4885

“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.