Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5455282

COc1ccc(C2CCN(CC(CO)C3CCNCC3)CC2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.43
▸ CHRM4 P08173 1/20 0.41
▸ SLC18A3 Q16572 1/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.40
▸ CCR2 P41597 4/20 0.40
▸ OPRM1 P35372 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ KDM1A O60341 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ APP P05067 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ORAI1 Q96D31 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ PRKAA2 P54646 1/20 0.39

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
SCHEMBL5328599 0.91 DRD2 (0.51) DRD2SLC18A3TAAR1CCR2
SCHEMBL5326193 0.82 DRD2 (0.51) DRD2CHRM4SLC18A3CCR2OPRM1
SCHEMBL5462617 0.79 DRD2 (0.54) DRD2SLC18A3TAAR1KDM1A
SCHEMBL5458686 0.78 ALDH1A1 (0.50) DRD2CHRM4ALDH1A1KDM4E
SCHEMBL5323533 0.76 DRD2 (0.49) DRD2SLC18A3CCR2OPRM1ALDH1A1
SCHEMBL5459675 0.74 CCR2 (0.56) CCR2ALDH1A1RAB9A
SCHEMBL14387014 0.74 CCR2 (0.56) CCR2ALDH1A1RAB9A
SCHEMBL5322776 0.72 CCR2 (0.46) DRD2SLC18A3CCR2OPRM1HSD11B1
SCHEMBL14386913 0.71 CCR2 (0.73) CCR2ALDH1A1RAB9A
SCHEMBL14386851 0.71 CCR2 (0.55) CCR2ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS JANSSEN PHARMACEUTCA N.V. (BE) 2007-08-23 — — 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-20070197590-A1 SUBSTITUTED DIPIPERIDINE CCR2 ANTAGONISTS CCR2, CCR1, CCR5 DRD2 284/4885CHRM4 3792/4885SLC18A3 4056/4885

“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.

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