SCHEMBL14699684

SCHEMBL14699684

Nc1ccnn2ccnc12

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 6/20 0.57
NUDT1 P36639 1/20 0.40
AXL P30530 1/20 0.38
CDK2 P24941 2/20 0.35
MAP4K4 O95819 1/20 0.34
NCF1 P14598 1/20 0.33
BMP4 P12644 1/20 0.33
DYRK1A Q13627 2/20 0.33
POLB P06746 1/20 0.32
PIM1 P11309 1/20 0.32
CDC7 O00311 1/20 0.32
IRAK4 Q9NWZ3 2/20 0.31
ADORA2A P29274 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
SCHEMBL446361 0.74 SMPD3 (0.38) SMPD3NUDT1AXLCDK2BMP4
SCHEMBL3122125 0.74 SMPD3 (0.38) SMPD3NUDT1AXLCDK2BMP4
SCHEMBL4569294 0.74 SMPD3 (0.38) SMPD3NUDT1AXLCDK2BMP4
SCHEMBL9935120 0.74 SMPD3 (0.38) SMPD3NUDT1AXLCDK2BMP4
SCHEMBL9124027 0.74 SMPD3 (0.39) SMPD3AXLCDK2BMP4POLB
SCHEMBL3023258 0.74 SMPD3 (0.40) SMPD3NUDT1AXLBMP4PIM1
SCHEMBL5791049 0.72 SMPD3 (1.00) SMPD3AXLCDK2BMP4IRAK4
SCHEMBL398829 0.72 MAP4K4 (0.60) SMPD3AXLMAP4K4
Hydrochloric Acid SCHEMBL3702394 0.72 SMPD3 (0.37) SMPD3NUDT1AXLCDK2BMP4
Hydrochloric Acid SCHEMBL31619326 0.72 SMPD3 (0.38) SMPD3AXLCDK2BMP4POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4028131-B1 HETEROAROMATIC COMPOUNDS USEFUL IN THERAPY CUROVIR AB (SE) 2023-11-22 EP claimed
US-20250282768-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2025-09-11 US disclosed
CN-113423708-B Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2025-04-22 CN disclosed
EP-4522607-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF-kB INDUCING KINASE JANSSEN Pharmaceutica NV (BE) 2025-03-19 EP disclosed
CN-113454086-B Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2025-03-14 CN disclosed
CN-119317626-A Pyrrolidone derivatives as inhibitors of NF- κb-induced kinase 詹森药业有限公司 2025-01-14 CN disclosed
WO-2023217851-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF-κB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2023-11-16 WO disclosed
EP-4055026-A1 COMPOUNDS AS CD73 INHIBITORS Bioardis LLC (US) 2022-09-14 EP disclosed
WO-2022061155-A1 IMIDAZOPYRIDAZINE AND IMIDAZOPYRAZINE COMPOUNDS AS INHIBITORS OF CDK7 THE TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2022-03-24 WO disclosed
US-20190135836-A1 HETEROCYCLIC KINASE INHIBITORS ABBVIE INC (US) 2019-05-09 US disclosed
US-10280184-B2 Heterocyclic kinase inhibitors ABBVIE INC. (US) 2019-05-07 US disclosed
US-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS EFFECTOR THERAPEUTICS, INC. 2017-05-25 US disclosed
US-20170114077-A1 HETEROCYCLIC KINASE INHIBITORS ABBVIE INC. 2017-04-27 US disclosed
EP-1928879-B1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL MYERS SQUIBB CO (US) 2013-02-13 EP 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 (5 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-20250282768-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE NFKBIA, IKBKG, IKBKB SMPD3 2082/4885NUDT1 2530/4885AXL 4714/4885
US-10280184-B2 Heterocyclic kinase inhibitors MAP3K1, MAP3K20, MAP3K19 SMPD3 2027/4885NUDT1 1271/4885AXL 419/4885
US-20170114077-A1 HETEROCYCLIC KINASE INHIBITORS MAP3K1, MAP3K20, MAP3K19 SMPD3 2027/4885NUDT1 1271/4885AXL 419/4885
US-20190135836-A1 HETEROCYCLIC KINASE INHIBITORS MAP3K1, MAP3K20, MAP3K19 SMPD3 2015/4885NUDT1 1385/4885AXL 407/4885
US-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS MAP3K9, MAP3K19, MAP3K20 SMPD3 3576/4885NUDT1 2911/4885AXL 776/4885

“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.