SCHEMBL3039949

SCHEMBL3039949

O=C1NCc2c(-c3ccccc3)ccc(I)c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K9 P80192 3/20 0.50
MAP3K11 Q16584 3/20 0.50
CLK1 P49759 1/20 0.49
CLK2 P49760 1/20 0.49
CLK3 P49761 1/20 0.49
PARP10 Q53GL7 2/20 0.44
PARP11 Q9NR21 2/20 0.44
WEE1 P30291 1/20 0.42
KDR P35968 6/20 0.42
CLK4 Q9HAZ1 2/20 0.41
DYRK1B Q9Y463 2/20 0.41
TYRO3 Q06418 1/20 0.41
NTRK2 Q16620 1/20 0.41
GRM2 Q14416 1/20 0.39
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PDE4B Q07343 1/20 0.38
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37

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
SCHEMBL3835838 0.83 TDP2 (0.42) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL3043388 0.81 KDR (0.54) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL18170548 0.76 ALDH1A1 (0.46) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL3048189 0.76 CDK5 (0.62) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL3034051 0.76 TDP2 (0.37) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL3836068 0.75 MAP3K9 (0.48) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL18170580 0.75 KDR (0.58) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL18171025 0.75 KDR (0.69) MAP3K9MAP3K11CLK1CLK2CLK3
SCHEMBL30331758 0.74 PARP10 (0.69) PARP10PARP11KDRCLK4DYRK1B
SCHEMBL3034052 0.74 BRD4 (0.41) MAP3K9MAP3K11CLK1CLK2CLK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-25 US claimed
US-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof DONG-A ST CO., LTD. (KR) 2025-03-04 US disclosed
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-25 US disclosed
US-7745641-B2 Nitrogen-containing heterocyclic compound KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-29 US disclosed
EP-2108642-A1 JAK INHIBITOR Kyowa Hakko Kirin Co., Ltd. (JP) 2009-10-14 EP disclosed
US-20090054407-A1 Nitrogen-containing heterocyclic compound KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-26 US disclosed
EP-1880993-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-01-23 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 (3 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-20090054407-A1 Nitrogen-containing heterocyclic compound NR4A1, NR5A2, PRMT8 MAP3K9 3221/4885MAP3K11 3080/4885CLK1 3126/4885
US-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof EIF2AK4, GCN1, GCGR MAP3K9 886/4885MAP3K11 935/4885CLK1 3882/4885
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF EIF2AK4, GCN1, GCGR MAP3K9 886/4885MAP3K11 935/4885CLK1 3882/4885

“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.