SCHEMBL5486455

SCHEMBL5486455

CC(C)(C)[Si](OCc1ccc(C2CC2)nc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GRM5 P41594 1/20 0.35
GRM1 Q13255 1/20 0.35
CSF1R P07333 3/20 0.34
SMYD2 Q9NRG4 2/20 0.32
DGAT1 O75907 2/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PRMT5 O14744 4/20 0.32
FFAR4 Q5NUL3 1/20 0.31
TRPV6 Q9H1D0 1/20 0.31
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 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
SCHEMBL3598538 0.79 GABRP (0.40)
SCHEMBL5486504 0.79 NLRP3 (0.41) MEN1KMT2AL3MBTL1
SCHEMBL1730850 0.79 TRPV6 (0.33) SMYD2CYP3A4HTTSMN1; SMN2TRPV6
SCHEMBL14449077 0.77 KDM1A (0.41) MEN1KMT2AGRM5CSF1RHTT
SCHEMBL5487616 0.77 KMT2A (0.36) MEN1KMT2AGRM5GRM1
SCHEMBL5490136 0.76 KDM4E (0.31) L3MBTL1
SCHEMBL4136544 0.76 GRM5 (0.38) GRM5GRM1SMYD2CYP3A4HTT
SCHEMBL1314001 0.75 AGXT (0.42) L3MBTL1SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1728926 0.75 MEN1 (0.33) MEN1KMT2AL3MBTL1SMYD2CYP3A4
SCHEMBL1729767 0.75 P4HTM (0.48) MEN1KMT2AL3MBTL1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244730-B2 2-iminopyrrolidine derivatives EISAI CO., LTD (JP) 2007-07-17 US disclosed
US-7244730-B2 2-iminopyrrolidine derivatives EISAI CO., LTD (JP) 2007-07-17 US disclosed
US-20050245592-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-03 US disclosed
US-20050004204-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-06 US disclosed
EP-1391451-A1 2-IMINOPYRROLIDINE DERIVATES Eisai Co., Ltd. (JP) 2004-02-25 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 (2 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-20050245592-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 MEN1 891/4885KMT2A 2082/4885L3MBTL1 3538/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 MEN1 859/4885KMT2A 2110/4885L3MBTL1 3543/4885

“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.