SCHEMBL30120764

SCHEMBL30120764

CC(C)n1nc(-c2ccc3c(c2F)CCN3C(=O)Cc2ccc(F)c(C(F)(F)F)c2)c2c(N)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 14/20 0.52
EIF2AK3 Q9NZJ5 7/20 0.50
CYP3A4 P08684 4/20 0.50
EIF2AK2 P19525 4/20 0.50
EIF2AK1 Q9BQI3 4/20 0.50
CYP2C9 P11712 3/20 0.50
EIF2AK4 Q9P2K8 2/20 0.50
CYP2C8 P10632 2/20 0.50
CYP2D6 P10635 2/20 0.50
PIK3CD O00329 2/20 0.45
ABL1 P00519 2/20 0.45
EGFR P00533 2/20 0.45
HCK P08631 2/20 0.45
SRC P12931 2/20 0.45
KDR P35968 2/20 0.45
PIK3CA P42336 2/20 0.45
PIK3CB P42338 2/20 0.45
MTOR P42345 2/20 0.45
PIK3CG P48736 2/20 0.45
EPHB4 P54760 2/20 0.45

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
SCHEMBL24650671 1.00 RIPK1 (0.52) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL24651094 0.94 RIPK1 (0.52) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL30120724 0.94 RIPK1 (0.52) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL30486107 0.93 RIPK1 (0.54) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL24650624 0.93 RIPK1 (0.54) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL24650646 0.89 RIPK1 (0.61) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL30120809 0.89 RIPK1 (0.61) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL24651167 0.88 EIF2AK3 (0.53) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL24650626 0.87 EIF2AK3 (0.50) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1
SCHEMBL30120857 0.87 EIF2AK3 (0.50) RIPK1EIF2AK3CYP3A4EIF2AK2EIF2AK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240382488-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-11-21 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
WO-2022212326-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-06 WO 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 (2 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-20240382488-A1 NEK7 INHIBITORS NEK7, NEK11, NEK2 RIPK1 537/4885EIF2AK3 2387/4885CYP3A4 2703/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 RIPK1 20/4885EIF2AK3 1310/4885CYP3A4 4174/4885

“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.