SCHEMBL247988

SCHEMBL247988

CC(C)(C(=O)O)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.39
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 1/20 0.32
PDK1 Q15118 2/20 0.31
PDK2 Q15119 2/20 0.31
PDK3 Q15120 2/20 0.31
PDK4 Q16654 2/20 0.31
TET2 Q6N021 1/20 0.31
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30

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
Dimethylformamide SCHEMBL18548326 0.83 TSHR (0.41) ALDH1A1TSHRTHRB
SCHEMBL15114663 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBCYP2D6CYP2C19
SCHEMBL9590096 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBCYP2D6CYP2C19
SCHEMBL14670247 0.79 ALDH1A1 (0.45) ALDH1A1TSHRTHRBCYP2D6CYP2C19
SCHEMBL26162970 0.79 ALDH1A1 (0.45) ALDH1A1TSHRTHRBCYP2D6CYP2C19
SCHEMBL85493 0.78 TSHR (0.57) ALDH1A1TSHRCYP2D6CYP2C19HIF1A
SCHEMBL10897817 0.78 THRB (0.43) ALDH1A1TSHRTHRBCYP2D6CYP2C19
SCHEMBL12856210 0.77 THRB (0.39) ALDH1A1TSHRTHRB
SCHEMBL28925386 0.77 THRB (0.56) ALDH1A1TSHRTHRB
SCHEMBL3923809 0.76 ALDH1A1 (0.32) ALDH1A1TSHR

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 610 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025024029-A1 METAL ORGANIC RESIST PHOTOSENSITIVITY IMPROVEMENT USING CARBOXYLIC ACID VERSUM MATERIALS US, LLC (US) 2025-01-30 WO claimed
CN-118165333-A Carbon fiber/polyether ketone prepreg cloth, composite material and preparation method thereof 东华大学 2024-06-11 CN claimed
CN-117568944-A Cable insulating layer material based on polyether ketone and preparation method thereof 东华大学 2024-02-20 CN claimed
CN-114685971-B Chopped carbon fiber/polyether ketone composite powder material and preparation method thereof 东华大学 2023-08-29 CN claimed
CN-116516573-A Electrostatic spinning preparation method of superfine non-adhesion polyether ketone nanofiber membrane 东华大学 2023-08-01 CN claimed
CN-116239808-A Cable insulation material based on polyether ketone and preparation method thereof 东华大学 2023-06-09 CN claimed
CN-114232109-B Method for preparing polyether ketone fiber based on nondestructive dissolution wet method 东华大学 2023-06-02 CN claimed
CN-115536493-A Simple method for preparing 3, 3-trifluoromethyl-2, 2-dimethylpropanol 海门瑞一医药科技有限公司 2022-12-30 CN claimed
CN-114685971-A Short carbon fiber/polyether ketone composite powder material and preparation method thereof 东华大学 2022-07-01 CN claimed
CN-114232109-A Method for preparing polyether ketone fiber based on nondestructive dissolution wet method 东华大学 2022-03-25 CN claimed
CN-113583426-A Preparation method of carbon fiber/polyether ketone composite material 东华大学 2021-11-02 CN claimed
US-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2021-08-12 US claimed
EP-3720849-A2 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR Vertex Pharmaceuticals Incorporated (US) 2020-10-14 EP claimed
CN-111757874-A Method for producing modulators of cystic fibrosis transmembrane conductance regulator 弗特克斯药品有限公司 2020-10-09 CN claimed
WO-2019113476-A2 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-06-13 WO claimed
CN-109134216-A A kind of preparation method of trifluoromethyl substituted carboxylic acid compound 浙江九洲药业股份有限公司 2019-01-04 CN claimed
JP-62204823-A None JP disclosed
JP-62097124-A None JP disclosed
JP-S62204823-A GAS SEPARATION ELEMENT WITH HIGH SELECTIVE PERMEABILITY NIPPON OIL & FATS CO LTD 1987-09-09 JP disclosed
JP-S6297124-A MAGNETIC RECORDING MEDIUM HITACHI LTD 1987-05-06 JP 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-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SCNN1G ALDH1A1 3381/4885TSHR 2590/4885THRB 1771/4885

“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.