SCHEMBL31724166

SCHEMBL31724166

COC(=O)C(CNC(=O)OC(C)(C)C)c1ccccc1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.47
SYK P43405 1/20 0.46
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
ITGA4 P13612 1/20 0.43
ITGB7 P26010 1/20 0.43
CACNA1B Q00975 1/20 0.41
TACR1 P25103 1/20 0.41
MALT1 Q9UDY8 1/20 0.40
IDO1 P14902 1/20 0.40
AAK1 Q2M2I8 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
EPHX2 P34913 1/20 0.39
KDM4A O75164 1/20 0.39

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
SCHEMBL30771240 0.90 DRD2 (0.47) DRD2SYKMTNR1AMTNR1BITGA4
SCHEMBL14974874 0.88 DRD2 (0.46) DRD2SYKMTNR1AMTNR1BITGA4
SCHEMBL4582959 0.84 DRD2 (0.49) DRD2SYKMTNR1AMTNR1BITGA4
SCHEMBL8242919 0.83 DRD2 (0.48) DRD2SYKMTNR1AMTNR1BITGA4
SCHEMBL6531538 0.82 SYK (0.52) SYKMALT1IDO1CTSSCTSK
SCHEMBL27406074 0.82 SYK (0.52) SYKMALT1IDO1CTSSCTSK
SCHEMBL27406072 0.82 SYK (0.52) SYKMALT1IDO1CTSSCTSK
SCHEMBL8660697 0.78 PPARA (0.44) SYKCTSSCTSKEPHX2
SCHEMBL31389109 0.77 CTSS (0.43) SYKAAK1CTSSCTSK
SCHEMBL31724161 0.77 NPSR1 (0.43) SYKMTNR1AMTNR1BCACNA1BCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 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 (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-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA DRD2 4708/4885SYK 1211/4885MTNR1A 962/4885

“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.