SCHEMBL470992

SCHEMBL470992

CC(C)(C)OCCCN1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.47
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TLR8 Q9NR97 1/20 0.45
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM4 P08173 1/20 0.44
CHRM3 P20309 1/20 0.44
ACKR3 P25106 3/20 0.43
HRH2 P25021 2/20 0.42
HRH1 P35367 2/20 0.42

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
SCHEMBL15217029 0.90 HRH2 (0.46) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL20873847 0.89 USP2 (0.53) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL16810242 0.88 EPHX2 (0.47) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL8253901 0.87 USP2 (0.51) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL12788403 0.85 MEN1 (0.46) EPHX2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL15217025 0.85 TLR8 (0.46) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL8242595 0.85 USP2 (0.61) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL214593 0.84 USP2 (0.49) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL5216019 0.84 USP2 (0.49) EPHX2USP2SMN1; SMN2TLR8CHRM2
SCHEMBL4543892 0.84 TLR8 (0.55) EPHX2USP2SMN1; SMN2TLR8CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822448-B2 Pyrazoloquinoline compound ASTELLAS PHARMA INC. (JP) 2014-09-02 US disclosed
US-8822448-B2 Pyrazoloquinoline compound ASTELLAS PHARMA INC. (JP) 2014-09-02 US disclosed
US-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-08-29 US disclosed
US-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-08-29 US disclosed
WO-2012033144-A1 PYRAZOLOQUINOLINE COMPOUND アステラス製薬株式会社 (JP) 2012-03-15 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-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND PDE9A, PDE5A, PDE2A EPHX2 2729/4885USP2 842/4885SMN1; SMN2 1786/4885

“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.