SCHEMBL30948565

SCHEMBL30948565

NC1c2ccccc2CC12CCN(Br)CC2

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 19/20 0.43
KCNH2 Q12809 3/20 0.43

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
SCHEMBL21940659 0.87 PTPN11 (0.47) PTPN11KCNH2
SCHEMBL23046087 0.87 PTPN11 (0.47) PTPN11KCNH2
SCHEMBL24388823 0.87 PTPN11 (0.47) PTPN11KCNH2
Hydrochloric Acid SCHEMBL29804135 0.84 HTR2A (0.42) PTPN11KCNH2
SCHEMBL21397503 0.83 PTPN11 (0.41) PTPN11KCNH2
SCHEMBL22523741 0.81 KCNH2 (0.47) PTPN11KCNH2
SCHEMBL22520446 0.81 CYP2D6 (0.47) PTPN11KCNH2
SCHEMBL23508887 0.81 KCNH2 (0.47) PTPN11KCNH2
SCHEMBL21887295 0.81 KCNH2 (0.47) PTPN11KCNH2
SCHEMBL22520440 0.81 CYP2D6 (0.47) PTPN11KCNH2

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-12233062-B2 Heterocyclic derivatives useful as SHP2 inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2025-02-25 US disclosed
US-20240285617-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-08-29 US disclosed
US-20240245681-A1 HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBO PHARMACEUTICATS CO LTD (CN) 2024-07-25 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-20240245681-A1 HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS PTPN1, PTPN5, PTPN2 PTPN11 11/4885KCNH2 4262/4885
US-20240285617-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS PTPN1, PTPN5, PTPN2 PTPN11 9/4885KCNH2 4301/4885
US-12233062-B2 Heterocyclic derivatives useful as SHP2 inhibitors PTPN1, PTPN5, PTPN2 PTPN11 11/4885KCNH2 4262/4885

“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.