SCHEMBL7024562

SCHEMBL7024562

CC(N)c1cn(C(=O)OC(C)(C)C)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
EPHX1 P07099 1/20 0.51
PIM1 P11309 1/20 0.47
MARK3 P27448 1/20 0.47
MAP4K2 Q12851 1/20 0.47
CAMK2B Q13554 1/20 0.47
PIM3 Q86V86 1/20 0.47
PIM2 Q9P1W9 1/20 0.47
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ACHE P22303 1/20 0.42
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
HTR6 P50406 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
PDE10A Q9Y233 1/20 0.40
BCHE P06276 1/20 0.40

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
SCHEMBL13570155 0.89 L3MBTL1 (0.55) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL30619496 0.89 L3MBTL1 (0.55) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL16726928 0.88 L3MBTL1 (0.54) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL9471393 0.86 L3MBTL1 (0.53) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL16100636 0.86 L3MBTL1 (0.48) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL30229659 0.86 L3MBTL1 (0.48) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL21525477 0.86 L3MBTL1 (0.48) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL12619833 0.86 L3MBTL1 (0.53) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL29651318 0.83 L3MBTL1 (0.53) L3MBTL1EPHX1PIM1MARK3MAP4K2
SCHEMBL25866702 0.83 L3MBTL1 (0.53) L3MBTL1EPHX1PIM1MARK3MAP4K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11420944-B2 Voltage-dependent t-type calcium channel blocker NIPPON CHEMIPHAR CO., LTD. (JP) 2022-08-23 US disclosed
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER NIPPON CHEMIPHAR CO., LTD. (JP) 2019-03-14 US disclosed
EP-3404021-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL INHIBITOR Nippon Chemiphar Co., Ltd. (JP) 2018-11-21 EP disclosed
EP-1206265-B1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2003-11-12 EP disclosed
US-6498165-B1 PYRIMIDINE COMPOUNDS; PROPHYLAXIS AND TREATMENT OF SUCH AS IMMUNE DISEASES, HYPERPROLIFERATIVE DISORDERS, CANCER, ANGIOGENSIS, ATHEROSCELEROSIS, GRAFT REJECTION, RHEUMATOID ARTHRITIS, PSORIASIS MERCK & CO., INC. 2002-12-24 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 (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-11420944-B2 Voltage-dependent t-type calcium channel blocker CACNA1I, CACNA1G, CACNA1E L3MBTL1 1700/4885EPHX1 4848/4885PIM1 4613/4885
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER CACNA1I, CACNA1G, CACNA1E L3MBTL1 1375/4885EPHX1 4832/4885PIM1 4679/4885

“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.