Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4155295

N[C@@H]1CC[C@H](C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.67
LMNA P02545 4/20 0.53
TSHR P16473 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
USP2 O75604 1/20 0.53
NOTUM Q6P988 1/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPK1 P28482 1/20 0.49
MAPT P10636 2/20 0.48
HPGD P15428 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL10993938 0.85 POLB (0.90) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL4161857 0.82 POLB (0.69) POLBLMNATSHRSMN1; SMN2USP2
Trifluoroacetic Acid SCHEMBL4336746 0.81 POLB (0.61) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL22494771 0.81 TDP1 (0.56) LMNATSHRSMN1; SMN2USP2HTT
SCHEMBL18901682 0.81 POLB (0.51) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL4150863 0.79 POLB (0.64) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL18901610 0.77 POLB (0.64) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL18901533 0.77 POLB (0.64) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL1779588 0.77 POLB (0.77) POLBLMNATSHRSMN1; SMN2USP2
SCHEMBL18901634 0.77 MAPT (0.50) POLBLMNAALDH1A1MAPT

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
US-8563582-B2 3-aminocyclopentanecarboxamides as modulators of chemokine receptors INCYTE CORPORATION (US) 2013-10-22 US disclosed
US-7618970-B2 3-aminocyclopentanecarboxamides as modulators of chemokine receptors INCYTE CORPORATION (US) 2009-11-17 US disclosed
US-20090208485-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORPORATION 2009-08-20 US disclosed
US-20060020133-A1 3-aminocyclopentanecarboxamides as modulators of chemokine receptors INCYTE CORPORATION 2006-01-26 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-20060020133-A1 3-aminocyclopentanecarboxamides as modulators of chemokine receptors CCR5, ACKR3, CXCR3 POLB 3655/4885LMNA 4589/4885TSHR 1220/4885
US-20090208485-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS CCR5, ACKR3, CXCR3 POLB 3655/4885LMNA 4589/4885TSHR 1220/4885

“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.