SCHEMBL16002876

SCHEMBL16002876

CNC1CCN(C(=O)Cc2cn(C)c3ccccc23)CC1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.62
▸ HTT P42858 4/20 0.59
▸ LMNA P02545 4/20 0.59
▸ MAPT P10636 3/20 0.59
▸ MAPK1 P28482 1/20 0.59
▸ ALDH1A1 P00352 3/20 0.57
▸ NPSR1 Q6W5P4 3/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ GAA P10253 1/20 0.49
▸ SYK P43405 1/20 0.48
▸ GPR84 Q9NQS5 1/20 0.48
▸ NPY5R Q15761 1/20 0.48
▸ BCHE P06276 1/20 0.48
▸ ACHE P22303 1/20 0.48
▸ TSHR P16473 1/20 0.47

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
SCHEMBL13825990 0.88 KDM4E (0.60) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL24723629 0.83 LMNA (0.68) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL29944211 0.82 LMNA (0.67) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL3455417 0.80 LMNA (0.58) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL16003045 0.79 TPSAB1 (0.57) KDM4E
SCHEMBL13825972 0.79 KDM4E (0.64) KDM4EMEN1KMT2A
SCHEMBL6218528 0.76 MAPT (0.50) KDM4EHTTLMNAMAPTALDH1A1
SCHEMBL16003000 0.76 MAPK1 (0.59) KDM4EMAPK1ALDH1A1MEN1KMT2A
SCHEMBL7505133 0.74 KDM4E (0.67) KDM4EHTTLMNAMAPTALDH1A1
SCHEMBL16002994 0.73 SYK (0.47) KDM4EALDH1A1SMN1; SMN2SYK

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 KDM4E 1409/4885HTT 4865/4885LMNA 4824/4885

“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.

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