Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL26983272

CON(C)C(=O)c1cnc(C2=CCNCC2)nc1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MLYCD O95822 1/20 0.36
▸ P2RY14 Q15391 1/20 0.33
▸ CCNT1 O60563 5/20 0.33
▸ CDK9 P50750 5/20 0.33
▸ QDPR P09417 2/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ GABRP O00591 1/20 0.32
▸ GABRD O14764 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ GABRB1 P18505 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRR1 P24046 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ GABRA3 P34903 1/20 0.32
▸ GABRA2 P47869 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ GABRA4 P48169 1/20 0.32
▸ GABRE P78334 1/20 0.32

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
SCHEMBL20759869 0.92 QDPR (0.36) MLYCDCCNT1CDK9QDPRSIGMAR1
SCHEMBL31701401 0.74 HRH3 (0.36) CCNT1CDK9QDPRSIGMAR1GABRP
SCHEMBL29531318 0.74 GABRP (0.49) P2RY14CCNT1CDK9QDPRSIGMAR1
Trifluoroacetic Acid SCHEMBL21003275 0.70 QDPR (0.42) CCNT1CDK9QDPRSIGMAR1HTR2C
Trifluoroacetic Acid SCHEMBL29803447 0.70 MAPKAPK2 (0.41) —
SCHEMBL28364566 0.69 ALDH1A1 (0.36) CCNT1CDK9QDPRTSHRHRH3
SCHEMBL29766145 0.69 RXFP1 (0.48) HTR2CHTR7HTR6LMNA
Trifluoroacetic Acid SCHEMBL30863752 0.69 HTR6 (0.38) P2RY14CCNT1CDK9HTR2CHTR7
Trifluoroacetic Acid SCHEMBL28452901 0.69 HTR6 (0.38) P2RY14CCNT1CDK9HTR2CHTR7
SCHEMBL15024196 0.69 HTR6 (0.45) CCNT1CDK9QDPRSIGMAR1HTR2C

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-20240010652-A1 COMPOSITIONS AND METHODS FOR TREATING KIT- AND PDGFRA-MEDIATED DISEASES BLUEPRINT MEDICINES CORPORATION 2024-01-11 — — US disclosed
CN-117098760-A Compositions and methods for treating KIT and PDGFRA mediated diseases 缆图药品公司 2023-11-21 — — CN disclosed
EP-4229060-A1 COMPOSITIONS AND METHODS FOR TREATING KIT-AND PDGFRA-MEDIATED DISEASES Blueprint Medicines Corporation (US) 2023-08-23 — — EP disclosed
WO-2022081627-A1 COMPOSITIONS AND METHODS FOR TREATING KIT-AND PDGFRA-MEDIATED DISEASES BLUEPRINT MEDICINES CORPORATION (US) 2022-04-21 — — WO 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-20240010652-A1 COMPOSITIONS AND METHODS FOR TREATING KIT- AND PDGFRA-MEDIATED DISEASES KIT, PDGFRA, PDGFRB MLYCD 3639/4885P2RY14 531/4885CCNT1 2790/4885

“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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