SCHEMBL4122754

SCHEMBL4122754

COC(=O)COCC1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
GRIN2B Q13224 12/20 0.56
CYP2C19 P33261 1/20 0.56
CYP2D6 P10635 4/20 0.55
CYP2C9 P11712 4/20 0.55
CYP3A4 P08684 3/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP3 P08254 1/20 0.48
MMP7 P09237 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48

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
SCHEMBL7011243 0.90 SMN1; SMN2 (0.57) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL4118940 0.88 SMN1; SMN2 (0.55) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL2527774 0.85 HTT (0.67) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL18946758 0.85 SMN1; SMN2 (0.67) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL25904933 0.83 SMN1; SMN2 (0.61) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL28978045 0.83 HTT (0.68) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL4111065 0.83 HTT (0.65) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL13425346 0.82 SMN1; SMN2 (0.60) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL5104335 0.82 SMN1; SMN2 (0.62) HTTSMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL7281136 0.81 HTT (0.65) HTTSMN1; SMN2NPC1RAB9AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 EP 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR HTT 1777/4885SMN1; SMN2 4445/4885NPC1 187/4885

“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.