SCHEMBL9890532

SCHEMBL9890532

COC(=O)Nc1cc(I)c(C)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3C3 Q8NEB9 5/20 0.40
▸ HPGD P15428 2/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ GCK P35557 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ AAK1 Q2M2I8 5/20 0.36
▸ GAK O14976 2/20 0.36
▸ ROCK2 O75116 2/20 0.36
▸ CIT O14578 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MKNK1 Q9BUB5 1/20 0.36
▸ MYLK2 Q9H1R3 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ CHRNA1 P02708 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36
▸ NR2C2 P49116 1/20 0.36
▸ TAB1 Q15750 1/20 0.36

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
SCHEMBL9108295 0.84 RAB9A (0.38) HPGDGCKHSD17B10NPC1RAB9A
SCHEMBL20861632 0.83 L3MBTL1 (0.53) PIK3C3GCKMKNK1MKNK2NPC1
SCHEMBL31627738 0.80 MTOR (0.44) PIK3C3HPGDJAK2JAK1TYK2
SCHEMBL24349061 0.79 ALDH1A1 (0.51) HPGDJAK2JAK1TYK2HSD17B10
SCHEMBL31627890 0.79 JAK2 (0.46) PIK3C3JAK2JAK1TYK2AAK1
SCHEMBL624567 0.78 NPC1 (0.54) NPC1RAB9A
SCHEMBL29878684 0.72 MAPK1 (0.47) HPGDHSD17B10CYP3A4
SCHEMBL31627910 0.72 ABL1 (0.46) PIK3C3AAK1
SCHEMBL21695369 0.72 NOTUM (0.50) PIK3C3HPGDGCKCYP3A4NPC1
SCHEMBL16705406 0.71 JAK2 (0.55) PIK3C3JAK2JAK1TYK2AAK1

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-20250236609-A1 VPS34 INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2025-07-24 — — US disclosed
WO-2025129019-A1 VPS34 INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC (US) 2025-06-19 — — WO disclosed
US-8859768-B2 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-10-14 — — US disclosed
US-20120142732-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-06-07 — — US disclosed
WO-2012021615-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-16 — — WO 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-20250236609-A1 VPS34 INHIBITORS AND METHODS OF USE THEREOF VPS35, VPS28, VPS26B PIK3C3 335/4885HPGD 4829/4885JAK2 1725/4885
US-20120142732-A1 HETEROARYLS AND USES THEREOF PIK3R4, PIK3C2B, PIK3R1 PIK3C3 52/4885HPGD 3886/4885JAK2 459/4885

“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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