SCHEMBL838744

SCHEMBL838744

CC(C)(C)[Si](C)(C)OC1CN(CC(O)C(=O)Nc2ccccn2)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.42
▸ MMP1 P03956 3/20 0.41
▸ MMP3 P08254 3/20 0.41
▸ MMP9 P14780 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ MMP2 P08253 1/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GCK P35557 1/20 0.38

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
SCHEMBL838743 1.00 KDM4E (0.44) KDM4EALDH1A1MMP1MMP3MMP9
SCHEMBL838685 0.84 RAB9A (0.40) RAB9AMEN1KMT2AGCK
SCHEMBL838686 0.84 RAB9A (0.40) RAB9AMEN1KMT2AGCK
SCHEMBL838638 0.84 KCNH2 (0.39) GCK
SCHEMBL838887 0.84 TSHR (0.47) KDM4EALDH1A1LMNAGCK
SCHEMBL838888 0.84 TSHR (0.47) KDM4EALDH1A1LMNAGCK
SCHEMBL838639 0.84 KCNH2 (0.39) GCK
SCHEMBL839438 0.82 GCK (0.38) GCK
SCHEMBL839439 0.82 GCK (0.38) GCK
SCHEMBL839500 0.81 USP30 (0.42) GCK

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
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 — — US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 — — US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 — — US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 — — 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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 KDM4E 3541/4885ALDH1A1 1918/4885MMP1 1262/4885

“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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