SCHEMBL22040955

SCHEMBL22040955

Cc1cnc(-c2cccc(B3OC(C)(C)C(C)(C)O3)c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 10/20 0.43
▸ LPL P06858 9/20 0.43
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ DGAT1 O75907 2/20 0.39
▸ HSD17B1 P14061 1/20 0.38
▸ HSD17B2 P37059 1/20 0.38
▸ ABL1 P00519 1/20 0.35
▸ EGFR P00533 1/20 0.34
▸ PDGFRB P09619 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ KDM1A O60341 1/20 0.32

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
SCHEMBL13274567 0.81 LIPG (0.43) LIPGLPLIRAK4DGAT1ABL1
SCHEMBL19766305 0.80 LIPG (0.47) LIPGLPLIRAK4DGAT1EGFR
SCHEMBL29412555 0.80 LIPG (0.56) LIPGLPLIRAK4DGAT1HSD17B1
SCHEMBL22660881 0.80 LIPG (0.56) LIPGLPLIRAK4DGAT1HSD17B1
SCHEMBL17413790 0.80 LPL (0.49) LIPGLPLIRAK4DGAT1PDGFRB
SCHEMBL29473308 0.79 LIPG (0.50) LIPGLPLIRAK4DGAT1EGFR
SCHEMBL806784 0.78 LIPG (0.60) LIPGLPLIRAK4EGFR
SCHEMBL31644025 0.77 LIPG (0.47) LIPGLPLIRAK4DGAT1PDGFRB
SCHEMBL30919897 0.77 LIPG (0.49) LIPGLPLDGAT1
SCHEMBL808246 0.77 LIPG (0.49) LIPGLPLDGAT1

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-11834449-B2 TYK2 inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-05 — — US disclosed
US-11834449-B2 TYK2 inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-05 — — US disclosed
US-11053241-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-07-06 — — US disclosed
WO-2020112937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2020-06-04 — — WO disclosed
US-20200172540-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-06-04 — — 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 (3 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-11834449-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LIPG 4560/4885LPL 4740/4885IRAK4 30/4885
US-11053241-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LIPG 4560/4885LPL 4740/4885IRAK4 30/4885
US-20200172540-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LIPG 4560/4885LPL 4740/4885IRAK4 30/4885

“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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