SCHEMBL13019709

SCHEMBL13019709

COc1cccc(Cc2nn(C(C)(C)C)c3ncnc(N)c23)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.73
AKT1 P31749 1/20 0.73
ABL1 P00519 7/20 0.58
RIPK2 O43353 1/20 0.58
PRKD3 O94806 1/20 0.58
FYN P06241 1/20 0.58
PRKACA P17612 1/20 0.58
CDK2 P24941 1/20 0.58
CSK P41240 1/20 0.58
MAPK8 P45983 1/20 0.58
CSNK1A1 P48729 1/20 0.58
CSNK1E P49674 1/20 0.58
PRKD1 Q15139 1/20 0.58
MAPK14 Q16539 1/20 0.58
PRKD2 Q9BZL6 1/20 0.58
CDK12 Q9NYV4 1/20 0.58
CAMK2A Q9UQM7 1/20 0.58
PIK3CD O00329 2/20 0.49
PIK3CA P42336 2/20 0.49
PIK3CB P42338 2/20 0.49

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
SCHEMBL1961935 0.86 SRC (0.62) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL1318810 0.86 SRC (0.79) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL30429079 0.85 SRC (0.78) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL30175068 0.85 SRC (0.78) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL12436052 0.85 SRC (0.78) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL13019704 0.84 SRC (0.76) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL13019850 0.84 SRC (1.00) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL12436150 0.84 AKT1 (1.00) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL409449 0.84 SRC (0.76) SRCAKT1ABL1RIPK2PRKD3
SCHEMBL12436053 0.84 SRC (0.76) SRCAKT1ABL1RIPK2PRKD3

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-12023385-B2 Tunable endogenous protein degradation with heterobifunctional compounds DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-07-02 US disclosed
EP-4119552-A1 REGULATING CHIMERIC ANTIGEN RECEPTORS Dana-Farber Cancer Institute, Inc. (US) 2023-01-18 EP disclosed
US-11311609-B2 Regulating chimeric antigen receptors DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-04-26 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 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 (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-12023385-B2 Tunable endogenous protein degradation with heterobifunctional compounds DBN1, MYCBP, PSMG3 SRC 3905/4885AKT1 4596/4885ABL1 2538/4885
US-11311609-B2 Regulating chimeric antigen receptors NFATC1, TNFRSF9, IL2RA SRC 303/4885AKT1 1695/4885ABL1 2453/4885
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING RAB1A, COPB1, GOLT1B SRC 1332/4885AKT1 968/4885ABL1 1725/4885

“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.