SCHEMBL30120865

SCHEMBL30120865

Nc1ncnc2c1c(-c1ccc3c(c1Cl)CCN3C(=O)Cc1cc(C(F)(F)F)ccc1F)nn2C1CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK3 Q9NZJ5 8/20 0.47
▸ RIPK1 Q13546 8/20 0.46
▸ EGFR P00533 1/20 0.44
▸ LCK P06239 4/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ EIF2AK2 P19525 3/20 0.43
▸ EIF2AK1 Q9BQI3 3/20 0.43
▸ CYP2C8 P10632 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ EIF2AK4 Q9P2K8 1/20 0.43
▸ BTK Q06187 2/20 0.42
▸ FYN P06241 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ YES1 P07947 1/20 0.41
▸ RET P07949 1/20 0.41
▸ KIT P10721 1/20 0.41
▸ AXL P30530 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL24650628 1.00 EIF2AK3 (0.47) EIF2AK3RIPK1EGFRLCKCYP3A4
SCHEMBL25793432 0.93 RIPK1 (0.48) EIF2AK3RIPK1EGFRLCKCYP3A4
SCHEMBL30120848 0.87 EIF2AK3 (0.47) EIF2AK3RIPK1EGFRLCKCYP3A4
SCHEMBL24650695 0.87 EIF2AK3 (0.47) EIF2AK3RIPK1EGFRLCKCYP3A4
SCHEMBL30120766 0.87 EIF2AK3 (0.48) EIF2AK3RIPK1LCKCYP3A4EIF2AK2
SCHEMBL24651067 0.87 EIF2AK3 (0.48) EIF2AK3RIPK1LCKCYP3A4EIF2AK2
SCHEMBL24651054 0.82 EIF2AK3 (0.43) EIF2AK3RIPK1LCKCYP3A4EIF2AK2
SCHEMBL30120820 0.82 EIF2AK3 (0.43) EIF2AK3RIPK1LCKCYP3A4EIF2AK2
SCHEMBL24651066 0.82 RIPK1 (0.59) EIF2AK3RIPK1EGFRLCKCYP3A4
SCHEMBL30120938 0.82 RIPK1 (0.59) EIF2AK3RIPK1EGFRLCKCYP3A4

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 EIF2AK3 2387/4885RIPK1 537/4885EGFR 2062/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 EIF2AK3 1310/4885RIPK1 20/4885EGFR 4872/4885

“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.

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