SCHEMBL13488461

SCHEMBL13488461

CC(=O)N1CCC(N(C)C(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.42
KDM4E B2RXH2 1/20 0.41
EPHX1 P07099 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.40
NPY5R Q15761 3/20 0.39
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MCHR1 Q99705 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL12227440 0.89 MCHR1 (0.38) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL12227441 0.89 MCHR1 (0.38) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL12227442 0.89 MCHR1 (0.38) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL23502255 0.80 NPY5R (0.41) EPHX2L3MBTL3NPY5RSMN1; SMN2ALDH1A1
SCHEMBL4550247 0.79 L3MBTL3 (0.58) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL17062871 0.79 EPHX2 (0.41) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL12227445 0.79 ALDH1A1 (0.35) EPHX2KDM4EEPHX1ALDH1A1
SCHEMBL23328554 0.79 TEAD1 (0.41) L3MBTL3
SCHEMBL19710577 0.78 KDM4E (0.45) EPHX2KDM4EEPHX1L3MBTL3NPY5R
SCHEMBL14997483 0.78 EPHX2 (0.43) EPHX2KDM4EEPHX1L3MBTL3NPY5R

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-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-11-09 US disclosed
US-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-11-09 US disclosed
US-8324257-B2 Mitotic kinesin inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-04 US disclosed
US-20100041719-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2010-02-18 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-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR AKT2, MTOR, AKT1 EPHX2 4379/4885KDM4E 2703/4885EPHX1 3844/4885
US-20100041719-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF KIF5B, KIF2C, KIF18B EPHX2 3595/4885KDM4E 938/4885EPHX1 3193/4885

“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.