SCHEMBL17603899

SCHEMBL17603899

CCOC(=O)c1noc(C(C)C)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 5/20 0.42
CYP1A2 P05177 2/20 0.42
FBP1 P09467 1/20 0.42
RAB9A P51151 1/20 0.40
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CACNA1F O60840 1/20 0.38
CACNA1D Q01668 1/20 0.38
CACNA1S Q13698 1/20 0.38
CACNA1C Q13936 1/20 0.38
MLYCD O95822 1/20 0.37

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
SCHEMBL25199116 0.83 LMNA (0.44) LMNAHTTALDH1A1MLYCDTDP2
SCHEMBL7080536 0.78 ALDH1A1 (0.49) LMNAHTTALDH1A1CYP1A2HPGD
SCHEMBL17603720 0.77 LMNA (0.67) LMNAHTTALDH1A1RAB9AHPGD
SCHEMBL16009163 0.76 ALDH1A1 (0.42) LMNAHTTALDH1A1HPGDKDM4E
SCHEMBL25194063 0.75 LMNA (0.39) LMNAHTTALDH1A1FBP1ADORA3
SCHEMBL17256524 0.74 SLC5A1 (0.38) LMNAHTTALDH1A1CYP1A2SMN1; SMN2
SCHEMBL27594096 0.73 ALDH1A1 (0.46) LMNAHTTALDH1A1CYP1A2RAB9A
SCHEMBL22377306 0.72 TDP2 (0.40) LMNAHTTALDH1A1CYP1A2HPGD
SCHEMBL18393249 0.72 TDP2 (0.40) LMNAHTTALDH1A1CYP1A2HPGD
SCHEMBL32659808 0.71 ALDH1A1 (0.44) LMNAHTTALDH1A1CYP1A2HPGD

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-20160083400-A1 TRICYCLIC GUANIDINE DERIVATIVE SUNOVION PHARMACEUTICALS INC (US) 2016-03-24 US disclosed
US-20160083400-A1 TRICYCLIC GUANIDINE DERIVATIVE SUNOVION PHARMACEUTICALS INC (US) 2016-03-24 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-20160083400-A1 TRICYCLIC GUANIDINE DERIVATIVE PDE3A, PDE2A, PDE5A LMNA 1418/4885HTT 3738/4885ALDH1A1 475/4885

“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.