SCHEMBL22404572

SCHEMBL22404572

O=C(O)C1CC1CCOCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 1/20 0.48
FFAR4 Q5NUL3 11/20 0.46
EPHX2 P34913 1/20 0.43
PDE4D Q08499 1/20 0.43
TSHR P16473 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL25390952 1.00 AGTR2 (0.48) AGTR2FFAR4EPHX2PDE4DTSHR
SCHEMBL25391356 1.00 AGTR2 (0.48) AGTR2FFAR4EPHX2PDE4DTSHR
SCHEMBL6267268 0.91 EPHX2 (0.47) AGTR2FFAR4EPHX2
SCHEMBL26951503 0.88 ALDH1A1 (0.44) AGTR2EPHX2PDE4DTSHRALDH1A1
SCHEMBL26951529 0.88 ALDH1A1 (0.44) AGTR2EPHX2PDE4DTSHRALDH1A1
SCHEMBL17391191 0.85 FFAR4 (0.57) AGTR2FFAR4TSHRALDH1A1CYP1A2
SCHEMBL5447182 0.85 FFAR4 (0.57) AGTR2FFAR4TSHRALDH1A1CYP1A2
SCHEMBL29018749 0.85 FFAR4 (0.57) AGTR2FFAR4TSHRALDH1A1CYP1A2
SCHEMBL5924916 0.85 FFAR4 (0.57) AGTR2FFAR4TSHRALDH1A1CYP1A2
SCHEMBL29188003 0.85 FFAR4 (0.57) AGTR2FFAR4TSHRALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034671-B2 Apoptosis signal-regulating kinase inhibitors and uses thereof SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2021-06-15 US disclosed
US-20200283404-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS AND USES THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2020-09-10 US 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 (2 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-20200283404-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS AND USES THEREOF DAPK1, ATF1, BAD AGTR2 322/4885FFAR4 3229/4885EPHX2 3525/4885
US-11034671-B2 Apoptosis signal-regulating kinase inhibitors and uses thereof DAPK1, ATF1, BAD AGTR2 322/4885FFAR4 3229/4885EPHX2 3525/4885

“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.