SCHEMBL14599656

SCHEMBL14599656

CC1CCCN(CCNC(=O)OC(C)(C)C)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.47
EPHX1 P07099 1/20 0.46
DRD2 P14416 2/20 0.46
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 2/20 0.43
HRH3 Q9Y5N1 7/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41

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
SCHEMBL14197690 0.92 CACNA1H (0.49) CACNA1HEPHX1DRD2ALDH1A1KMT2A
SCHEMBL13635148 0.86 DRD2 (0.48) CACNA1HEPHX1DRD2KMT2AGAA
SCHEMBL13635147 0.86 CACNA1H (0.47) CACNA1HEPHX1DRD2KMT2AGAA
SCHEMBL18233688 0.84 DRD2 (0.46) CACNA1HEPHX1DRD2KMT2AGAA
SCHEMBL6007685 0.84 SLC6A1 (0.46) CACNA1HEPHX1DRD2KMT2AMEN1
SCHEMBL6007677 0.84 SLC6A1 (0.46) CACNA1HEPHX1DRD2KMT2AMEN1
SCHEMBL26003617 0.83 CACNA1H (0.51) CACNA1HEPHX1DRD2ALDH1A1KMT2A
SCHEMBL16480069 0.83 CACNA1H (0.54) CACNA1HEPHX1DRD2
SCHEMBL24172673 0.82 DRD2 (0.56) CACNA1HEPHX1DRD2KMT2AGAA
SCHEMBL31301250 0.82 DRD2 (0.56) CACNA1HEPHX1DRD2KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010516-A1 Novel piperidine derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2007-01-11 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-20070010516-A1 Novel piperidine derivatives UTS2R, VIPR2, NTSR2 CACNA1H 1051/4885EPHX1 1555/4885DRD2 59/4885

“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.