SCHEMBL19708909

SCHEMBL19708909

CCNC(C(N)=O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGAV P06756 1/20 0.33
ITGA5 P08648 1/20 0.33
CNR2 P34972 3/20 0.32
CNR1 P21554 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX1 P07099 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
HPGDS O60760 1/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G5 P39877 1/20 0.31
ENPEP Q07075 2/20 0.30
HTT P42858 1/20 0.30
CA12 O43570 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL9714133 1.00 ITGB3 (0.33) ITGB3ITGB1ITGAVITGA5CNR2
Carbamic Acid SCHEMBL27983163 0.96 ITGB3 (0.35) ITGB3ITGB1ITGAVITGA5CNR2
SCHEMBL24218813 0.86 ENPEP (0.35) CNR2CNR1SMN1; SMN2HPGDSENPEP
SCHEMBL21917418 0.84 EPHX1 (0.31) EPHX1CA1CA2
SCHEMBL21843952 0.84 EPHX1 (0.31) EPHX1CA1CA2
SCHEMBL21034776 0.84 EPHX1 (0.31) EPHX1CA1CA2
SCHEMBL16852138 0.82 SMN1; SMN2 (0.37) CNR2CNR1SMN1; SMN2EPHX1CA1
SCHEMBL30700134 0.82 ALDH1A1 (0.41) CA1CA2ENPEPHTT
SCHEMBL14012364 0.81 HPGDS (0.31) ITGB3ITGB1ITGAVITGA5HPGDS
SCHEMBL26439512 0.80 HTT (0.35) SMN1; SMN2CA1HTTCA12

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-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 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-20170355708-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 ITGB3 3611/4885ITGB1 2339/4885ITGAV 2262/4885

“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.