SCHEMBL3680427

SCHEMBL3680427

CC(C)(Cc1ccncc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.47
RAB9A P51151 1/20 0.45
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
BLM P54132 1/20 0.42
GAA P10253 2/20 0.40
NAPRT Q6XQN6 1/20 0.40
CYP19A1 P11511 2/20 0.40
TSHR P16473 1/20 0.40
SLC22A12 Q96S37 1/20 0.39
PTPRB P23467 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL31336881 0.84 FDPS (0.47) FDPSRAB9ABLMGAACYP19A1
SCHEMBL6643278 0.84 FDPS (0.47) FDPSRAB9ABLMGAANAPRT
SCHEMBL517462 0.81 SMN1; SMN2 (0.57) FDPSBLMALDH1A1SMN1; SMN2HIF1A
SCHEMBL8266516 0.81 BLM (0.66) FDPSRAB9ABLMGAANAPRT
SCHEMBL31036573 0.81 BLM (0.66) FDPSRAB9ABLMGAANAPRT
SCHEMBL23579874 0.79 PTPRB (0.52) FDPSRAB9AGAACYP19A1TSHR
SCHEMBL27925093 0.79 ESR1 (0.56) CYP4F2CYP4A11BLMGAASLC22A12
SCHEMBL28997201 0.79 FDPS (0.50) FDPSRAB9AGAANAPRTCYP19A1
SCHEMBL28246706 0.79 HIF1A (0.55) FDPSBLMTSHRALDH1A1SMN1; SMN2
SCHEMBL28727407 0.79 SMN1; SMN2 (0.55) FDPSBLMALDH1A1SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0730598-B1 HINDERED ESTERS OF RAPAMYCIN AND THEIR USE AS PHARMACEUTICALS AMERICAN HOME PROD (US) 1999-06-09 EP claimed
EP-0730598-A1 HINDERED ESTERS OF RAPAMYCIN AND THEIR USE AS PHARMACEUTICALS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-11 EP claimed
WO-1995014696-A1 HINDERED ESTERS OF RAPAMYCIN AND THEIR USE AS PHARMACEUTICALS AMERICAN HOME PRODUCTS CORPORATION (US) 1995-06-01 WO claimed
US-5385908-A Hindered esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1995-01-31 US claimed
CN-115151550-B External nucleotide pyrophosphatase/phosphodiesterase 1 (ENPP 1) modulators and uses thereof 桑福德·伯纳姆·普雷比医学发现研究所 2024-11-22 CN disclosed
US-20230121698-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute 2023-04-20 US disclosed
EP-4081528-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2022-11-02 EP disclosed
CN-115151550-A Ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP 1) modulators and uses thereof 桑福德·伯纳姆·普雷比医学发现研究所 2022-10-04 CN disclosed
WO-2021133915-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2021-07-01 WO disclosed
WO-2021133915-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2021-07-01 WO disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
EP-0558673-B1 RETROVIRAL PROTEASE INHIBITORS MONSANTO CO (US) 1996-04-17 EP disclosed
US-5475013-A Inhibit human immunodeficiency virus protease MONSANTO COMPANY (US) 1995-12-12 US disclosed
WO-1995014696-A1 HINDERED ESTERS OF RAPAMYCIN AND THEIR USE AS PHARMACEUTICALS AMERICAN HOME PRODUCTS CORPORATION (US) 1995-06-01 WO disclosed
US-5385908-A Hindered esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1995-01-31 US disclosed
EP-0558603-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1993-09-08 EP disclosed
EP-0558673-A1 RETROVIRAL PROTEASE INHIBITORS. MONSANTO CO (US) 1993-09-08 EP disclosed
WO-1992008699-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 WO disclosed
WO-1992008688-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 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-20230121698-A1 ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF ENPP1, ENPP3, PPA1 FDPS 129/4885RAB9A 960/4885CYP4F2 3454/4885

“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.