SCHEMBL1912705

SCHEMBL1912705

CC(C)(C)OC(=O)N1CCC(CCc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.62
PKM P14618 1/20 0.62
STS P08842 1/20 0.59
GPR119 Q8TDV5 5/20 0.59
JAK2 O60674 1/20 0.53
JAK1 P23458 1/20 0.53
GAA P10253 1/20 0.53
THRB P10828 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
YAP1 P46937 2/20 0.52
TGFBR1 P36897 1/20 0.51
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
FAAH O00519 1/20 0.50

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
SCHEMBL8263539 0.94 KDM4E (0.56) KDM4EPKMSTSGPR119JAK2
SCHEMBL13913655 0.92 KDM4E (0.60) KDM4EPKMSTSGPR119JAK2
SCHEMBL3358948 0.91 KDM4E (0.59) KDM4EPKMSTSGPR119JAK2
SCHEMBL1532820 0.89 KDM4E (0.55) KDM4EPKMSTSGPR119JAK2
SCHEMBL12736015 0.88 KDM4E (0.56) KDM4EPKMSTSGPR119FAAH
SCHEMBL13282013 0.88 MAOB (0.53) KDM4EPKMGPR119TGFBR1MAOB
SCHEMBL20015389 0.88 GPR119 (0.60) KDM4EPKMGPR119SMN1; SMN2MAOB
SCHEMBL30824890 0.88 GPR119 (0.58) KDM4EPKMSTSGPR119FAAH
SCHEMBL3923737 0.88 KDM4E (0.64) KDM4EPKMSTSGPR119FAAH
SCHEMBL28341502 0.88 NAMPT (0.54) KDM4EPKMSTSGPR119JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 US disclosed
WO-2018055096-A1 DISUBTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES AS INHIBITORS OF MONOAMINE OXIDASE B FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF LJUBLJANA (SI) 2018-03-29 WO disclosed
US-20120010135-A1 SPIRO DERIVATIVES FOR THE MODULATION OF STEAROYL-COA DESATURASE XENON PHARMACEUTICALS INC. (CA) 2012-01-12 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 (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-20120010135-A1 SPIRO DERIVATIVES FOR THE MODULATION OF STEAROYL-COA DESATURASE SCD, SCD5, FADS2 KDM4E 1529/4885PKM 2363/4885STS 94/4885
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION VIM, ACE, ACE2 KDM4E 2900/4885PKM 3044/4885STS 1343/4885

“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.