SCHEMBL18947871

SCHEMBL18947871

CC1CCN(CCCNC(=O)OC(C)(C)C)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.54
TDP1 Q9NUW8 1/20 0.49
SIGMAR1 Q99720 2/20 0.48
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
CACNA1H O95180 1/20 0.46
EPHX1 P07099 1/20 0.45

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
SCHEMBL25031746 0.96 DRD2 (0.55) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL16480069 0.91 CACNA1H (0.54) DRD2TDP1CACNA1HEPHX1
SCHEMBL25032149 0.89 HRH3 (0.48) DRD2TDP1SIGMAR1MEN1KMT2A
SCHEMBL24619896 0.89 DRD2 (0.54) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL22699069 0.89 DRD2 (0.54) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL8254760 0.88 DRD2 (0.64) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL6700 0.87 DRD2 (0.53) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL24922242 0.85 DRD2 (0.51) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL22703621 0.85 DRD2 (0.54) DRD2TDP1SIGMAR1MEN1GAA
SCHEMBL21815267 0.84 DRD2 (0.50) DRD2TDP1SIGMAR1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281773-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-10-05 US disclosed
US-9675697-B2 BET bromodomain inhibitors and therapeutic methods using the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-06-13 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-20170281773-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME BRD4, BRDT, BRD3 DRD2 4222/4885TDP1 546/4885SIGMAR1 4451/4885

“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.