SCHEMBL1732640

SCHEMBL1732640

CCOc1[c]c(C(C)(C)C)cc(C(=O)CN2Cc3cc(OCC)c(OCC)c(F)c3C2=N)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2R P25116 6/20 0.62
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 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
SCHEMBL1730562 0.93 F2R (0.57) F2R
SCHEMBL1732837 0.91 F2R (0.58) F2RGAAALDH1A1KDM4EMAPT
SCHEMBL6544807 0.88 F2R (0.59) F2RSMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL28740924 0.85 F2R (0.70) F2R
Bromide SCHEMBL1728973 0.85 F2R (0.71) F2RKDM4EMAPTRAB9ANPC1
SCHEMBL1731035 0.84 F2R (0.78) F2RGAAALDH1A1KDM4EMAPT
SCHEMBL1729720 0.84 F2R (0.69) F2RSMN1; SMN2GAA
Bromide SCHEMBL1730905 0.83 F2R (0.62) F2RSMN1; SMN2GAAALDH1A1KDM4E
Bromide SCHEMBL1730472 0.83 F2R (0.69) F2RSMN1; SMN2GAAKDM4EMAPT
Bromide SCHEMBL1729136 0.83 F2R (0.79) F2RGAAALDH1A1KDM4EMAPT

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
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-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 2290/4885SMN1; SMN2 2355/4885GAA 4867/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885SMN1; SMN2 2369/4885GAA 4868/4885

“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.