SCHEMBL22164183

SCHEMBL22164183

CC(C)(C)OC(=O)c1cc(F)ccc1OCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.55
CYSLTR1 Q9Y271 1/20 0.49
PTGDR2 Q9Y5Y4 10/20 0.47
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 2/20 0.42
GLA P06280 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
PTGDR Q13258 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRA4 P48169 1/20 0.41
GABRA6 Q16445 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL22176183 0.84 PKM (0.59) PKMCYSLTR1PTGDR2SMN1; SMN2POLB
SCHEMBL718460 0.81 PTGDR2 (0.68) PKMCYSLTR1PTGDR2SMN1; SMN2POLB
SCHEMBL4138843 0.81 PKM (0.71) PKMCYSLTR1PTGDR2SMN1; SMN2POLB
SCHEMBL6984002 0.77 SMN1; SMN2 (0.40) SMN1; SMN2POLBL3MBTL1ALDH1A1HTT
SCHEMBL5778950 0.77 ADRA1A (0.38) PKMALDH1A1GABRA1GABRG2GABRB3
SCHEMBL22164222 0.76 RAB9A (0.35) PKMCYSLTR1SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL14502985 0.76 CYP2C19 (0.63) PKMPTGDR2CYP2C19SMN1; SMN2POLB
SCHEMBL12466303 0.76 ALDH1A1 (0.54) PKMPTGDR2CYP2C19SMN1; SMN2POLB
SCHEMBL18045699 0.75 PKM (0.72) PKMPTGDR2SMN1; SMN2POLBGLA
Ethane SCHEMBL4640227 0.75 KEAP1 (0.46) CYP2C19SMN1; SMN2ALDH1A1GABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230069963-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2023-03-09 US disclosed
EP-3903788-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND Taisho Pharmaceutical Co., Ltd. (JP) 2021-11-03 EP disclosed
WO-2020138015-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND 大正製薬株式会社 2020-07-02 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-20230069963-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND ZC3HAV1, ZC3HAV1L, IL5 PKM 1698/4885CYSLTR1 2139/4885PTGDR2 3861/4885

“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.