SCHEMBL18612199

SCHEMBL18612199

NC(=O)c1cc(-c2ccc(C(=O)N3CCC(N4CCCC4)CC3)c(N)c2)cnc1N

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL3 Q96JM7 8/20 0.59
▸ L3MBTL1 Q9Y468 8/20 0.59
▸ MERTK Q12866 5/20 0.58
▸ AXL P30530 4/20 0.58
▸ MET P08581 3/20 0.51
▸ TP53BP1 Q12888 3/20 0.48
▸ MBTD1 Q05BQ5 2/20 0.47
▸ PIK3C3 Q8NEB9 1/20 0.47
▸ LRRK2 Q5S007 1/20 0.44
▸ ATR Q13535 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ MTOR P42345 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
SCHEMBL18611892 0.90 MERTK (0.55) L3MBTL3L3MBTL1MERTKAXLMET
SCHEMBL18612197 0.88 MERTK (0.59) L3MBTL3L3MBTL1MERTKAXLMET
SCHEMBL21779411 0.85 AXL (0.60) L3MBTL3L3MBTL1MERTKAXLTP53BP1
SCHEMBL21779419 0.82 MERTK (0.61) MERTKAXL
SCHEMBL18615821 0.82 MERTK (0.58) L3MBTL3L3MBTL1MERTKAXLMET
SCHEMBL18615511 0.79 BMPR1B (0.62) L3MBTL3L3MBTL1MERTKAXLMET
SCHEMBL21779417 0.79 MERTK (0.64) L3MBTL3L3MBTL1MERTKAXLTP53BP1
SCHEMBL18611887 0.78 MERTK (0.59) L3MBTL3L3MBTL1MERTKAXLMBTD1
SCHEMBL18616315 0.77 MERTK (0.60) MERTKAXLMETLRRK2
SCHEMBL18616326 0.75 BMPR1B (0.57) MERTKAXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3344613-B1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG A SOCIO HOLDINGS CO LTD (KR) 2020-03-04 — — EP disclosed
US-20170355690-A9 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2017-12-14 — — US disclosed
US-20170066742-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO LTD (KR) 2017-03-09 — — US disclosed
WO-2017039331-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2017-03-09 — — WO 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 (2 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-20170355690-A9 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC L3MBTL3 3333/4885L3MBTL1 3774/4885MERTK 1/4885
US-20170066742-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC L3MBTL3 3333/4885L3MBTL1 3774/4885MERTK 1/4885

“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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