Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6485341

CN(C)CC1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.38

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 3/20 0.38
GABRB2 P47870 3/20 0.38
SLC6A1 P30531 2/20 0.38
SLC6A12 P48065 2/20 0.38
SLC6A11 P48066 2/20 0.38
SLC6A13 Q9NSD5 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRA4 P48169 2/20 0.38
GABRR1 P24046 1/20 0.38
ITGB3 P05106 3/20 0.37
ITGA2B P08514 3/20 0.37
CPN1 P15169 1/20 0.37
CPB2 Q96IY4 1/20 0.37
SLC6A2 P23975 5/20 0.36
SLC6A4 P31645 5/20 0.36
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35

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
Trifluoroacetic Acid SCHEMBL3008294 0.85 USP30 (0.38) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Trifluoroacetic Acid SCHEMBL6485494 0.85 ITGB3 (0.39) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Trifluoroacetic Acid SCHEMBL3056977 0.82 SLC6A2 (0.47) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
SCHEMBL249558 0.81 GBA1 (0.35) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Trifluoroacetic Acid SCHEMBL2997803 0.80 GABRA5 (0.40) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Trifluoroacetic Acid SCHEMBL19502951 0.79 ALOX5 (0.36)
Trifluoroacetic Acid SCHEMBL19502953 0.79 ALOX5 (0.36)
Hydrochloric Acid SCHEMBL29194368 0.79 GNAO1 (0.37) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Ammonia Solution, Strong SCHEMBL30463186 0.79 GBA1 (0.34) GABRA5GABRB2SLC6A1SLC6A12SLC6A11
Hydrochloric Acid SCHEMBL3553551 0.79 GNAO1 (0.37) GABRA5GABRB2SLC6A1SLC6A12SLC6A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1312153-C Pyrrolopyrimidinone derivatives, process for their preparation and their use SK CHEMICALS CO LTD (KR) 2007-04-25 CN disclosed
US-6962911-B2 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2005-11-08 US disclosed
EP-1257553-B1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO LTD (KR) 2004-05-26 EP disclosed
US-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2003-09-11 US disclosed
CN-1422271-A Pyrrolopyrimidinone derivatives, process for their preparation and their use SK CHEMICALS CO LTD (KR) 2003-06-04 CN disclosed
EP-1257553-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK Chemicals Co., Ltd. (KR) 2002-11-20 EP disclosed
WO-2001060825-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO., LTD. (KR) 2001-08-23 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-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use CYP2C19, DHPS, SDHA GABRA5 2467/4885GABRB2 3491/4885SLC6A1 3871/4885

“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.