SCHEMBL29980920

SCHEMBL29980920

CC(N)c1nc2cc(C3=NC[C@@H](C)CC3)ccc2s1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 2/20 0.41
▸ LIPG Q9Y5X9 4/20 0.32
▸ NOS3 P29474 1/20 0.31
▸ NOS1 P29475 1/20 0.31
▸ NOS2 P35228 1/20 0.31
▸ LOXL2 Q9Y4K0 1/20 0.31
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CB P42338 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ FTO Q9C0B1 1/20 0.30
▸ ALOX5 P09917 1/20 0.30

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
SCHEMBL24364958 0.87 AAK1 (0.36) AAK1LIPGALOX5
SCHEMBL30470940 0.87 AAK1 (0.36) AAK1LIPGALOX5
SCHEMBL30469929 0.84 AAK1 (0.36) AAK1LIPGLOXL2
SCHEMBL24365042 0.84 AAK1 (0.36) AAK1LIPGLOXL2
SCHEMBL24233998 0.84 AAK1 (0.36) AAK1LIPGLOXL2
SCHEMBL29980678 0.83 AAK1 (0.35) AAK1LOXL2
SCHEMBL24364315 0.83 PIK3CA (0.48) NOS3NOS1NOS2PIK3CDPIK3CA
SCHEMBL30469738 0.83 PIK3CA (0.48) NOS3NOS1NOS2PIK3CDPIK3CA
SCHEMBL31136351 0.82 SMN1; SMN2 (0.40) —
SCHEMBL24363782 0.82 SMN1; SMN2 (0.40) —

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-11492350-B2 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2022-11-08 — — 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-11492350-B2 Compounds and methods of use F12, C1R, ABCG2 AAK1 4778/4885LIPG 2618/4885NOS3 556/4885

“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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