Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1729212

CCOc1cc2c(cc1C(=O)NC)C(=N)N(CC(=O)c1ccc(OCC(=O)O)c(C3CCCC3)c1)C2.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 13/20 0.41
PTGDR Q13258 6/20 0.37
PTGER2 P43116 1/20 0.37
F2R P25116 3/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
ITGA2 P17301 1/20 0.33
SCN9A Q15858 1/20 0.33
PTPN1 P18031 1/20 0.31

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
SCHEMBL1729215 0.90 PTGDR2 (0.34) PTGDR2PTGDRF2RKDM4ENPC1
Trifluoroacetic Acid SCHEMBL6544759 0.85 F2R (0.37) F2RKDM4ENPC1MAPTRAB9A
Bromide SCHEMBL5484979 0.85 KDM4E (0.39) F2RKDM4ENPC1MAPTRAB9A
Bromide SCHEMBL5486564 0.83 MAPT (0.40) PTGDRF2RKDM4ENPC1MAPT
Bromide SCHEMBL5490703 0.82 F2R (0.43) PTGDR2F2RKDM4ENPC1MAPT
Bromide SCHEMBL1730838 0.82 MEN1 (0.46) F2RKDM4ENPC1MAPTRAB9A
Hydrochloric Acid SCHEMBL5483217 0.81 F2R (0.42) PTGDR2F2RKDM4ENPC1MAPT
Hydrochloric Acid SCHEMBL1732022 0.80 PTGDR (0.38) PTGDRF2RKDM4ENPC1MAPT
Bromide SCHEMBL7613855 0.80 F2R (0.38) F2RKDM4ENPC1MAPTRAB9A
Trifluoroacetic Acid SCHEMBL1730949 0.80 F2R (0.43) F2RKDM4ENPC1MAPTRAB9A

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-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 PTGDR2 549/4885PTGDR 487/4885PTGER2 1044/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 PTGDR2 544/4885PTGDR 488/4885PTGER2 1028/4885

“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.