SCHEMBL898973

SCHEMBL898973

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

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL21374571 0.79 ALDH1A1 (0.33) ALDH1A1CYP2C19
SCHEMBL19573882 0.77
SCHEMBL18254496 0.77
SCHEMBL18254494 0.77
SCHEMBL12886177 0.76 ALDH1A1 (0.32) ALDH1A1CYP2C19
SCHEMBL754899 0.76 ALDH1A1 (0.39) ALDH1A1CYP2C19
SCHEMBL12886174 0.76 ALDH1A1 (0.32) ALDH1A1CYP2C19
SCHEMBL751715 0.76 ALDH1A1 (0.39) ALDH1A1CYP2C19
SCHEMBL9927173 0.76 ALDH1A1 (0.39) ALDH1A1CYP2C19
SCHEMBL12885916 0.76 ALDH1A1 (0.32) ALDH1A1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-20230346781-A1 SMALL MOLECULE INHIBITORS OF CANCER STEM CELLS AND MESENCHYMAL CANCER TYPES THE SCRIPPS RESEARCH INSTITUTE (US) 2023-11-02 US disclosed
US-20230321086-A1 METHODS AND MATERIALS FOR INHIBITING NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-10-12 US disclosed
US-20230322818-A1 SILICON COMPOUND, REACTIVE MATERIAL, RESIN COMPOSITION, PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, METHOD OF MANUFACTURING CURED FILM, PATTERNED CURED FILM, AND METHOD OF MANUFACTURING PATTERNED CURED FILM CENTRAL GLASS COMPANY, LIMITED (JP) 2023-10-12 US disclosed
US-20230310424-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-10-05 US disclosed
US-20230314939-A1 CARBOXYLATE, CARBOXYLIC ACID GENERATOR, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-05 US disclosed
US-11759461-B2 Small molecule inhibitors of cancer stem cells and mesenchymal cancer types THE SCRIPPS RESEARCH INSTITUTE (US) 2023-09-19 US disclosed
WO-2023171487-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED ARTICLE, DISPLAY DEVICE, AND METHOD FOR PRODUCING DISPLAY DEVICE 東レ株式会社 2023-09-14 WO disclosed
EP-3743430-B1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-02 EP disclosed
US-11712485-B2 Triazine based radiopharmaceuticals and radioimaging agents MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2023-08-01 US disclosed
US-7300932-B2 Pyrrolo[1,2-b]pyridazine derivatives JAPAN TOBACCO INC. (JP) 2007-11-27 US disclosed
US-20070244096-A1 Fused Bicyclic Nitrogen-Containing Heterocycles JAPAN TOBACCO INC. (JP) 2007-10-18 US disclosed
US-20070219338-A1 Self-assembling polymer film material, self-assembled pattern, and pattern forming method SHIN-ETSU CHEMICAL CO., LTD. 2007-09-20 US disclosed
US-20070219338-A1 Self-assembling polymer film material, self-assembled pattern, and pattern forming method SHIN-ETSU CHEMICAL CO., LTD. 2007-09-20 US disclosed
EP-1829850-A2 Fluoroalcohol preparation method, fluorinated monomer, polymer, resist composition and patterning process Shin-Etsu Chemical Co., Ltd. (JP) 2007-09-05 EP disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
WO-2007024125-A1 FIBROUS 3-DIMENSIONAL SCAFFOLD VIA ELECTROSPINNING FOR TISSUE REGENERATION AND METHOD FOR PREPARING THE SAME EWHA UNIVERSITY-INDUSTRY COLLABORATION FOUNDATION (KR) 2007-03-01 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 (11 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-20230321086-A1 METHODS AND MATERIALS FOR INHIBITING NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE ACTIVITY NAMPT, NNMT, NAPRT ALDH1A1 1806/4885CYP2C19 4864/4885
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 ALDH1A1 2353/4885CYP2C19 465/4885
US-20230310424-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE ACTIVITY NAMPT, NNMT, NAPRT ALDH1A1 1726/4885CYP2C19 4765/4885
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 ALDH1A1 2353/4885CYP2C19 465/4885
US-11712485-B2 Triazine based radiopharmaceuticals and radioimaging agents PSMA2, PSMA5, PSMA1 ALDH1A1 2027/4885CYP2C19 3249/4885
US-20230346781-A1 SMALL MOLECULE INHIBITORS OF CANCER STEM CELLS AND MESENCHYMAL CANCER TYPES VIM, CDH1, BRCA1 ALDH1A1 521/4885CYP2C19 4861/4885
US-20230314939-A1 CARBOXYLATE, CARBOXYLIC ACID GENERATOR, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN H1-10, H1-0, HCAR1 ALDH1A1 124/4885CYP2C19 2996/4885
US-20230322818-A1 SILICON COMPOUND, REACTIVE MATERIAL, RESIN COMPOSITION, PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, METHOD OF MANUFACTURING CURED FILM, PATTERNED CURED FILM, AND METHOD OF MANUFACTURING PATTERNED CURED FILM RAD51, RER1, RPS4Y1 ALDH1A1 1130/4885CYP2C19 1459/4885
US-20070244096-A1 Fused Bicyclic Nitrogen-Containing Heterocycles PC, HCCS, MYC ALDH1A1 2218/4885CYP2C19 3494/4885
US-20230365525-A1 ANTIVIRAL COMPOUNDS ACE, ZC3HAV1, SARS1 ALDH1A1 2152/4885CYP2C19 193/4885
US-11759461-B2 Small molecule inhibitors of cancer stem cells and mesenchymal cancer types VIM, BRCA1, CDH1 ALDH1A1 536/4885CYP2C19 4868/4885

“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.