Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL18261734

CC(C(=O)NCCN)N1C(=O)C=CC1=O.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ TACR1 P25103 1/20 0.37
▸ TACR3 P29371 1/20 0.37
▸ SLC1A2 P43004 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ESR1 P03372 2/20 0.35
▸ ESR2 Q92731 2/20 0.35
▸ CSNK1D P48730 2/20 0.34
▸ TERT O14746 2/20 0.34
▸ IKBKB O14920 1/20 0.33
▸ CDK11B P21127 1/20 0.33
▸ CDK7 P50613 1/20 0.33
▸ CDK13 Q14004 1/20 0.33
▸ MAP3K19 Q56UN5 1/20 0.33
▸ MYLK4 Q86YV6 1/20 0.33
▸ CDK11A Q9UQ88 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL17841877 0.90 TERT (0.40) AKT1TSHRCYP3A4SLC1A2SMN1; SMN2
SCHEMBL30269173 0.90 TERT (0.40) AKT1TSHRCYP3A4SLC1A2SMN1; SMN2
Trifluoroacetic Acid SCHEMBL27959221 0.80 ALDH1A1 (0.35) AKT1NPY1R
SCHEMBL16652232 0.76 TSHR (0.44) AKT1TSHRCYP3A4SLC1A2SMN1; SMN2
SCHEMBL12107712 0.76 SLC1A2 (0.40) TSHRSLC1A2SMN1; SMN2HTTL3MBTL1
SCHEMBL20677165 0.75 TACR1 (0.32) AKT1TACR1TACR3TERT
SCHEMBL18877419 0.74 SMN1; SMN2 (0.41) TSHRSLC1A2SMN1; SMN2HTT
Trifluoroacetic Acid SCHEMBL18261651 0.73 PKM (0.38) AKT1SMN1; SMN2ESR1ESR2CSNK1D
SCHEMBL10037527 0.73 CPB2 (0.34) SLC1A2TERT
SCHEMBL10037495 0.73 SLC1A2 (0.42) TSHRSLC1A2SMN1; SMN2HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230039341-A1 ANTIBODY DRUG CONJUGATES (ADCS) AND ANTIBODY PRODRUG CONJUGATES (APDCS) WITH ENZYMATICALLY CLEAVABLE GROUPS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2023-02-09 — — US disclosed
US-11071788-B2 Antibody drug conjugates of kinesin spindel protein (KSP) inhibitors with antiB7H3-antibodies BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-07-27 — — US disclosed
US-10744205-B2 Antibody drug conjugates of kinesin spindel protein (KSP) inhibitors with anti-CD123-antibodies BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-08-18 — — US disclosed
US-20200138970-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTIB7H3-ANTIBODIES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-07 — — US disclosed
US-20180318437-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTI-CD123-ANTIBODIES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-11-08 — — US disclosed
US-10022453-B2 Antibody drug conjugates (ADCs) with kinesin spindel protein (KSP) BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-07-17 — — US disclosed
US-20180185510-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTI-B7H3-ANTIBODIES Bayer Pharma AG (DE) 2018-07-05 — — US disclosed
US-20180015176-A1 ANTIBODY-DRUG CONJUGATES (ADCS) OF KSP INHIBITORS WITH AGLYCOSYLATED ANTI-TWEAKR ANTIBODIES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-01-18 — — US disclosed
US-20160346402-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH KINESIN SPINDEL PROTEIN (KSP) BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-01 — — 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 (9 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-10744205-B2 Antibody drug conjugates of kinesin spindel protein (KSP) inhibitors with anti-CD123-antibodies KIF23, KIF2C, KIF18A AKT1 3824/4885TSHR 3684/4885CYP3A4 4715/4885
US-10022453-B2 Antibody drug conjugates (ADCs) with kinesin spindel protein (KSP) KIF5B, KIF23, KIF2C AKT1 2463/4885TSHR 4052/4885CYP3A4 4711/4885
US-11071788-B2 Antibody drug conjugates of kinesin spindel protein (KSP) inhibitors with antiB7H3-antibodies KIF23, KIF5B, KIF2C AKT1 3148/4885TSHR 4473/4885CYP3A4 4637/4885
US-20180185510-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTI-B7H3-ANTIBODIES KIF23, KIF5B, KIF2C AKT1 2957/4885TSHR 3868/4885CYP3A4 4771/4885
US-20180015176-A1 ANTIBODY-DRUG CONJUGATES (ADCS) OF KSP INHIBITORS WITH AGLYCOSYLATED ANTI-TWEAKR ANTIBODIES TNFSF11, TNFRSF9, CD40 AKT1 4093/4885TSHR 2038/4885CYP3A4 4541/4885
US-20200138970-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTIB7H3-ANTIBODIES KIF23, KIF5B, KIF2C AKT1 3148/4885TSHR 4473/4885CYP3A4 4637/4885
US-20160346402-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH KINESIN SPINDEL PROTEIN (KSP) KIF5B, KIF23, KIF2C AKT1 2463/4885TSHR 4052/4885CYP3A4 4711/4885
US-20180318437-A1 ANTIBODY DRUG CONJUGATES OF KINESIN SPINDEL PROTEIN (KSP) INHIBITORS WITH ANTI-CD123-ANTIBODIES KIF23, KIF2C, KIF18A AKT1 3824/4885TSHR 3684/4885CYP3A4 4715/4885
US-20230039341-A1 ANTIBODY DRUG CONJUGATES (ADCS) AND ANTIBODY PRODRUG CONJUGATES (APDCS) WITH ENZYMATICALLY CLEAVABLE GROUPS KIFC1, KIF2C, KIF5B AKT1 2462/4885TSHR 4525/4885CYP3A4 2245/4885

“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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