SCHEMBL30381944

SCHEMBL30381944

COc1cc(N2CCC(O)CC2)ccc1Nc1nc(Nc2ccccc2S(=O)(=O)C(C)C)c2[nH]cnc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 5/20 1.00
▸ FES P07332 3/20 0.74
▸ FLT3 P36888 3/20 0.74
▸ DCLK1 O15075 2/20 0.71
▸ ALK Q9UM73 14/20 0.66
▸ GAK O14976 3/20 0.62
▸ INSR P06213 3/20 0.62
▸ IGF1R P08069 3/20 0.62
▸ LTK P29376 3/20 0.62
▸ PTK2 Q05397 3/20 0.62
▸ TNK2 Q07912 3/20 0.62
▸ TNK1 Q13470 3/20 0.62
▸ PTK2B Q14289 3/20 0.62
▸ ZAP70 P43403 2/20 0.62
▸ INSRR P14616 2/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ CLK1 P49759 2/20 0.62
▸ BMPR1B O00238 2/20 0.61
▸ PLK4 O00444 2/20 0.61
▸ ERN1 O75460 2/20 0.61

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
SCHEMBL18018796 0.89 TTK (0.80) TTKFESFLT3DCLK1ALK
SCHEMBL3954048 0.85 FES (1.00) TTKFESFLT3DCLK1ALK
SCHEMBL17731666 0.85 TTK (1.00) TTKFESFLT3DCLK1ALK
SCHEMBL3959324 0.85 TTK (0.74) TTKFESFLT3DCLK1ALK
SCHEMBL14866359 0.85 TTK (0.81) TTKFESFLT3DCLK1ALK
SCHEMBL14866370 0.84 ALK (0.80) TTKFESFLT3DCLK1ALK
SCHEMBL18018799 0.83 TTK (0.70) TTKFESFLT3DCLK1ALK
SCHEMBL19867365 0.82 ALK (0.84) TTKFESFLT3DCLK1ALK
SCHEMBL14866207 0.82 ALK (0.84) TTKFESFLT3DCLK1ALK
SCHEMBL17731758 0.82 TTK (0.75) TTKFESFLT3DCLK1ALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101836-A1 METHOD FOR INDUCING ANEUPLOIDY AND/OR CHROMOSOMAL INSTABILITY IN HUMAN OR NON-HUMAN PRIMATE PLURIPOTENT STEM CELLS AND DIAGNOSTIC/THERAPEUTIC USES THEREOF THE TRUSTEES OF DARTMOUTH COLLEGE (US) 2025-05-15 — — WO claimed
EP-4527946-A1 METHOD FOR PREDICTING THE RESPONSE TO A DUAL SPECIFICITY PROTEIN KINASE TTK INHIBITOR THERAPY Pangaea Oncology, S.A (ES) 2025-03-26 — — EP claimed
WO-2023233148-A1 CANCER THERAPY THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL, (GB) 2023-12-07 — — WO claimed
US-20250295686-A1 COMBINATION DECITABINE AND MPS1 INHIBITOR THERAPY TO PRIME CANCER IMMUNOGENICITY DANA-FARBER CANCER INSTITUTE, INC. 2025-09-25 — — US disclosed
WO-2025101836-A1 METHOD FOR INDUCING ANEUPLOIDY AND/OR CHROMOSOMAL INSTABILITY IN HUMAN OR NON-HUMAN PRIMATE PLURIPOTENT STEM CELLS AND DIAGNOSTIC/THERAPEUTIC USES THEREOF THE TRUSTEES OF DARTMOUTH COLLEGE (US) 2025-05-15 — — WO disclosed
EP-4527946-A1 METHOD FOR PREDICTING THE RESPONSE TO A DUAL SPECIFICITY PROTEIN KINASE TTK INHIBITOR THERAPY Pangaea Oncology, S.A (ES) 2025-03-26 — — EP disclosed
EP-4419209-A1 COMBINATION DECITABINE AND MPS1 INHIBITOR THERAPY TO PRIME CANCER IMMUNOGENICITY Dana-Farber Cancer Institute, Inc. (US) 2024-08-28 — — EP disclosed
WO-2023243971-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DEMYELINATING DISEASE, COMPRISING KINASE INHIBITOR AS ACTIVE INGREDIENT 고려대학교 산학협력단 2023-12-21 — — WO disclosed
WO-2023233148-A1 CANCER THERAPY THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL, (GB) 2023-12-07 — — WO disclosed
WO-2023069943-A1 COMBINATION DECITABINE AND MPS1 INHIBITOR THERAPY TO PRIME CANCER IMMUNOGENICITY DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-04-27 — — WO disclosed
Send feedback