SCHEMBL14736182

SCHEMBL14736182

Nc1ncnc2[nH]cc(I)c(=O)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.51
RET P07949 4/20 0.38
TRPA1 O75762 1/20 0.37
MAPK1 P28482 2/20 0.35
MET P08581 1/20 0.32
PIK3CD O00329 4/20 0.32
PIK3CA P42336 4/20 0.32
PIK3CB P42338 4/20 0.32
PIK3CG P48736 4/20 0.32
PRKDC P78527 4/20 0.32
LRRK2 Q5S007 3/20 0.32
PI4KA P42356 3/20 0.32
PI4K2B Q8TCG2 3/20 0.32
PI4K2A Q9BTU6 3/20 0.32
PI4KB Q9UBF8 3/20 0.32
XDH P47989 2/20 0.32
LMNA P02545 1/20 0.32
DRD3 P35462 1/20 0.32
ERAP1 Q9NZ08 1/20 0.32
NOTUM Q6P988 1/20 0.31

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
SCHEMBL397485 0.85 CHEK1 (0.63) CHEK1RETTRPA1MAPK1PIK3CD
SCHEMBL5805420 0.72 RET (0.43) CHEK1RETPIK3CDPIK3CAPIK3CB
SCHEMBL30052782 0.71 RET (0.42) CHEK1RETTRPA1LRRK2PI4KA
SCHEMBL22912722 0.71 CHEK1 (0.66) CHEK1TRPA1MAPK1LRRK2NOTUM
SCHEMBL6531144 0.71 RET (0.42) CHEK1RETTRPA1LRRK2PI4KA
SCHEMBL23735452 0.69 CHEK1 (0.48) CHEK1RETTRPA1LRRK2PI4KA
SCHEMBL10259826 0.69 AKT1 (0.45) CHEK1RETTRPA1PIK3CDPIK3CA
SCHEMBL868756 0.69 RET (0.41) CHEK1RETMAPK1LRRK2PI4KA
SCHEMBL25776394 0.69 TRPA1 (0.51) CHEK1RETTRPA1JAK2
SCHEMBL19743349 0.69 CHEK1 (0.41) CHEK1RETTRPA1PIK3CDPIK3CA

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250325550-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORP (US) 2025-10-23 US disclosed
EP-3888657-B1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORP (US) 2025-03-19 EP disclosed
US-12201636-B2 Heterocyclylamines as PI3K inhibitors INCYTE CORPORATION (US) 2025-01-21 US disclosed
US-20240216377-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION 2024-07-04 US disclosed
US-20240216377-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION 2024-07-04 US disclosed
US-11819505-B2 Heterocyclylamines as PI3K inhibitors INCYTE CORPORATION (US) 2023-11-21 US disclosed
US-11819505-B2 Heterocyclylamines as PI3K inhibitors INCYTE CORPORATION (US) 2023-11-21 US disclosed
US-20230121440-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORPORATION 2023-04-20 US disclosed
US-20230121440-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORPORATION 2023-04-20 US disclosed
US-11433071-B2 Heterocyclylamines as PI3K inhibitors INCYTE CORPORATION (US) 2022-09-06 US disclosed
US-9707233-B2 Heterocyclylamines as PI3K inhibitors INCYTE HOLDINGS CORPORATION (US) 2017-07-18 US disclosed
EP-2751109-B1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORP (US) 2016-11-30 EP disclosed
US-9309251-B2 Bicyclic azaheterocyclobenzylamines as PI3K inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-04-12 US disclosed
US-20160024117-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION 2016-01-28 US disclosed
US-20160022685-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION 2016-01-28 US disclosed
US-9199982-B2 Heterocyclylamines as PI3K inhibitors INCYTE HOLDINGS CORPORATION (US) 2015-12-01 US disclosed
EP-2751109-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS Incyte Corporation (US) 2014-07-09 EP disclosed
US-20130261101-A1 BICYCLIC AZAHETEROCYCLOBENZYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION 2013-10-03 US disclosed
WO-2013033569-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2013-03-07 WO disclosed
US-20130059835-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2013-03-07 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 (10 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-20230121440-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-20250325550-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-20240216377-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-20160024117-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-11819505-B2 Heterocyclylamines as PI3K inhibitors PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-11433071-B2 Heterocyclylamines as PI3K inhibitors PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-20160022685-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-12201636-B2 Heterocyclylamines as PI3K inhibitors PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885
US-20130261101-A1 BICYCLIC AZAHETEROCYCLOBENZYLAMINES AS PI3K INHIBITORS PIK3CD, PIK3CA, PIK3CB CHEK1 783/4885RET 882/4885TRPA1 4207/4885
US-20130059835-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB CHEK1 221/4885RET 994/4885TRPA1 2943/4885

“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.