SCHEMBL1729286

SCHEMBL1729286

CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1ccc(O)c(C(C)(C)C)c1)C2

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2R P25116 7/20 0.65
HSP90AA1 P07900 8/20 0.37
HSP90AB1 P08238 8/20 0.37
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
PDE5A O76074 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSP90B1 P14625 1/20 0.32
TRAP1 Q12931 1/20 0.32

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
Bromide SCHEMBL1730193 0.99 F2R (0.66) F2RHSP90AA1HSP90AB1KDM4EMAPT
SCHEMBL28740928 0.93 F2R (0.59) F2RHSP90AA1HSP90AB1KDM4EMAPT
SCHEMBL28740924 0.90 F2R (0.70) F2R
SCHEMBL6544433 0.90 F2R (0.64) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1728973 0.89 F2R (0.71) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1730529 0.89 F2R (0.64) F2RKDM4EMAPTRAB9ANPC1
SCHEMBL14469088 0.89 F2R (0.52) F2RHSP90AA1HSP90AB1HSP90B1TRAP1
SCHEMBL1729720 0.89 F2R (0.69) F2RSMN1; SMN2
Bromide SCHEMBL1732000 0.88 F2R (0.64) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1730472 0.88 F2R (0.69) F2RKDM4EMAPTRAB9ANPC1

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
EP-1391451-B1 2-IMINOPYRROLIDINE DERIVATES EISAI R&D MAN CO LTD (JP) 2011-11-23 EP disclosed
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

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 F2R 2290/4885HSP90AA1 1439/4885HSP90AB1 1613/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885HSP90AA1 1438/4885HSP90AB1 1605/4885

“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.