SCHEMBL18370064

SCHEMBL18370064

CN1C(=O)c2ccccc2N(C)c2cc(Nc3ccc(CN4CC[C@H](N5CCCC5)C4)cc3)ncc21

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK7 Q13164 8/20 0.55
▸ BRD4 O60885 6/20 0.55
▸ KCNH2 Q12809 1/20 0.55
▸ LRRK2 Q5S007 8/20 0.44
▸ DCLK1 O15075 5/20 0.41
▸ BRDT Q58F21 2/20 0.37
▸ NUAK1 O60285 1/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ PIK3C2G O75747 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ AURKB Q96GD4 1/20 0.37
▸ WEE1 P30291 1/20 0.36
▸ CNR2 P34972 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
SCHEMBL18369873 0.90 MAPK7 (0.58) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369907 0.77 MAPK7 (0.74) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369799 0.77 MAPK7 (0.51) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369924 0.76 MAPK7 (0.59) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369850 0.73 MAPK7 (0.92) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18370024 0.71 MAPK7 (0.85) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL17059935 0.71 MAPK7 (0.85) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL17059933 0.71 MAPK7 (1.00) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL17059926 0.71 MAPK7 (0.82) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369919 0.69 MAPK7 (0.56) MAPK7BRD4KCNH2LRRK2DCLK1

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-20170008888-A1 HETEROCYCLIC COMPOUNDS ACTIVX BIOSCIENCES, INC. 2017-01-12 — — US disclosed
US-20170008888-A1 HETEROCYCLIC COMPOUNDS ACTIVX BIOSCIENCES, INC. 2017-01-12 — — 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-20170008888-A1 HETEROCYCLIC COMPOUNDS BET1, EP300, RBBP5 MAPK7 58/4885BRD4 4/4885KCNH2 4491/4885

“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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