SCHEMBL24837426

SCHEMBL24837426

COc1cc2nccc(OCC3CCCCC3)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 2/20 0.57
▸ EPHA2 P29317 3/20 0.53
▸ KDR P35968 3/20 0.53
▸ EPHB4 P54760 3/20 0.53
▸ PDGFRA P16234 5/20 0.53
▸ KIT P10721 3/20 0.53
▸ PDGFRB P09619 1/20 0.50
▸ ERBB2 P04626 1/20 0.48
▸ FLT3 P36888 1/20 0.48
▸ MET P08581 1/20 0.47

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
SCHEMBL24009188 0.83 IRAK4 (0.47) IRAK4EPHA2KDREPHB4PDGFRA
SCHEMBL4400367 0.79 PDGFRB (0.72) PDGFRAPDGFRB
SCHEMBL5501482 0.78 IRAK4 (0.49) IRAK4
SCHEMBL15580123 0.76 KDR (0.56) IRAK4EPHA2KDREPHB4KIT
SCHEMBL5824748 0.76 PDGFRA (0.83) KDRPDGFRAKITFLT3MET
SCHEMBL5824898 0.76 PDGFRA (0.83) KDRPDGFRAKITFLT3MET
SCHEMBL5508687 0.75 IRAK4 (0.49) IRAK4
SCHEMBL17137654 0.74 IRAK4 (0.65) IRAK4
SCHEMBL30497408 0.74 IRAK4 (0.65) IRAK4
SCHEMBL5825712 0.74 PDGFRA (0.59) KDRPDGFRAKITFLT3MET

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-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 — — US disclosed
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-01-05 — — 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-11780849-B2 Imino sulfanone inhibitors of ENPP1 ENPP1, ENPP3, SMPD1 IRAK4 2820/4885EPHA2 3521/4885KDR 3654/4885
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 ENPP1, ENPP3, SMPD1 IRAK4 2820/4885EPHA2 3521/4885KDR 3654/4885

“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.

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