Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4816285

NCC1(c2ccc(Cl)cc2)CCN(C(=O)CN2CCN(c3cnccn3)CC2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
GFER P55789 1/20 0.39
AKT2 P31751 3/20 0.39
GSK3B P49841 3/20 0.39
MRGPRX1 Q96LB2 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.37
DPP4 P27487 3/20 0.37
GPR6 P46095 1/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36

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
SCHEMBL5755134 0.94 GFER (0.44) SMN1; SMN2GFERAKT2GSK3BMRGPRX1
Trifluoroacetic Acid SCHEMBL4810619 0.92 TACR1 (0.42) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL5760860 0.86 SLC6A7 (0.46) MEN1ALDH1A1MAPTKMT2ANPSR1
SCHEMBL4806920 0.83 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4EIRAK4
SCHEMBL2809020 0.81 KDM4E (0.47) SMN1; SMN2MEN1ALDH1A1MAPTKMT2A
SCHEMBL4812861 0.80 IRAK4 (0.40) SMN1; SMN2MEN1ALDH1A1MAPTKMT2A
SCHEMBL4808795 0.79 GFER (0.43) SMN1; SMN2GFERMRGPRX1ALDH1A1KDM4E
Trifluoroacetic Acid SCHEMBL27607925 0.76 SLC6A7 (0.38) ALDH1A1KDM4EDPP4GPR6DRD4
SCHEMBL4814964 0.76 ALDH1A1 (0.48) MEN1ALDH1A1KMT2ANPSR1DRD4
SCHEMBL4811981 0.73 KDM4E (0.48) SMN1; SMN2MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468368-B2 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2008-12-23 US disclosed
US-20050176722-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2005-08-11 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 (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-20050176722-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof NR5A2, NR3C1, CBR1 SMN1; SMN2 2222/4885GFER 1092/4885AKT2 3869/4885

“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.