SCHEMBL21929907

SCHEMBL21929907

Cc1cc(B2OC(C)(C)C(C)(C)O2)cc2cnn(C(C)C3CC3)c12

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.35
FFAR1 O14842 1/20 0.31
LPL P06858 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL14251544 0.76 IRAK4 (0.41) IRAK4FFAR1LPLLIPG
SCHEMBL21929910 0.76 CRHR1 (0.31)
SCHEMBL21929819 0.74 LPL (0.30) LPLLIPG
SCHEMBL30748768 0.73 IRAK4 (0.36) IRAK4FFAR1LPLLIPG
SCHEMBL18480146 0.72 CYP4F2 (0.39) IRAK4
SCHEMBL28664045 0.71 FFAR1 (0.39) IRAK4FFAR1LPLLIPG
SCHEMBL18985993 0.70 FFAR1 (0.45) IRAK4FFAR1LPLLIPG
SCHEMBL16728686 0.70 IRAK4 (0.38) IRAK4FFAR1LPLLIPG
SCHEMBL30551179 0.69 IRAK4 (0.47) IRAK4FFAR1LPLLIPG
SCHEMBL31221824 0.69 ADORA3 (0.38) IRAK4FFAR1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12006320-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2024-06-11 US disclosed
US-20210395258-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2021-12-23 US disclosed
US-20210395258-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2021-12-23 US disclosed
US-11161838-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2021-11-02 US disclosed
US-11161838-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2021-11-02 US disclosed
US-11078204-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2021-08-03 US disclosed
US-11078204-B2 Heterocyclic derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2021-08-03 US disclosed
WO-2020102198-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2020-05-22 WO disclosed
WO-2020102198-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2020-05-22 WO disclosed
WO-2020102150-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2020-05-22 WO disclosed
WO-2020102150-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2020-05-22 WO disclosed
US-20200148689-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2020-05-14 US disclosed
US-20200148689-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2020-05-14 US disclosed
US-20200148671-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2020-05-14 US disclosed
US-20200148671-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2020-05-14 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 (6 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-11161838-B2 Heterocyclic derivatives as PI3K inhibitors PIK3CD, PIK3R5, PIK3CG IRAK4 441/4885FFAR1 3157/4885LPL 2867/4885
US-12006320-B2 Heterocyclic derivatives as PI3K inhibitors PIK3CD, PIK3R5, PIK3CA IRAK4 309/4885FFAR1 2276/4885LPL 2811/4885
US-11078204-B2 Heterocyclic derivatives as PI3K inhibitors PIK3CD, PIK3R5, PIK3CA IRAK4 309/4885FFAR1 2276/4885LPL 2811/4885
US-20200148671-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS PIK3CD, PIK3R5, PIK3CG IRAK4 441/4885FFAR1 3157/4885LPL 2867/4885
US-20210395258-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS PIK3CD, PIK3R5, PIK3CA IRAK4 309/4885FFAR1 2276/4885LPL 2811/4885
US-20200148689-A1 HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS PIK3CD, PIK3R5, PIK3CA IRAK4 309/4885FFAR1 2276/4885LPL 2811/4885

“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.