SCHEMBL13635148

SCHEMBL13635148

CC(C)(C)OC(=O)NCCN1CCCC(Cl)C1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.48
CACNA1H O95180 3/20 0.47
EPHX1 P07099 1/20 0.46
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 2/20 0.41
KCNH2 Q12809 2/20 0.41
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM5 P08912 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL14599656 0.86 CACNA1H (0.47) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL13635147 0.86 CACNA1H (0.47) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL18233688 0.84 DRD2 (0.46) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL6007685 0.84 SLC6A1 (0.46) DRD2CACNA1HEPHX1MEN1KMT2A
SCHEMBL6007677 0.84 SLC6A1 (0.46) DRD2CACNA1HEPHX1MEN1KMT2A
SCHEMBL24172673 0.82 DRD2 (0.56) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL4024516 0.82 DRD2 (0.56) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL31301250 0.82 DRD2 (0.56) DRD2CACNA1HEPHX1MEN1GAA
SCHEMBL485945 0.81 DRD2 (0.55) DRD2CACNA1HEPHX1MEN1KMT2A
SCHEMBL7220892 0.81 DRD2 (0.55) DRD2CACNA1HEPHX1MEN1KMT2A

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
EP-1858836-B1 ANALOGUES OF THE AZINOMYCINS AS ANTI-TUMOUR AGENTS AND AS PRODRUGS UNIV BRADFORD (GB) 2009-11-18 EP disclosed
US-20090233966-A1 Analogues of the Azinomycins as Anti-Tumour Agents and as Prodrugs SCHOOL OF PHARMACY, UNIVERSITY OF LONDON (GB) 2009-09-17 US disclosed
US-20090233966-A1 Analogues of the Azinomycins as Anti-Tumour Agents and as Prodrugs SCHOOL OF PHARMACY, UNIVERSITY OF LONDON (GB) 2009-09-17 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-20090233966-A1 Analogues of the Azinomycins as Anti-Tumour Agents and as Prodrugs CYP1B1, AZI2, ECI1 DRD2 3657/4885CACNA1H 3257/4885EPHX1 301/4885

“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.