SCHEMBL25625019

SCHEMBL25625019

CCn1cc(Cc2cc(Cl)nn2-c2ccc(F)cc2C(C)Oc2cc(Br)cnc2[N+](=O)[O-])cn1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.33
MAPT P10636 1/20 0.32
ALK Q9UM73 3/20 0.31

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
SCHEMBL30227878 1.00 JAK2 (0.33) JAK2MAPTALK
SCHEMBL25624939 0.94 ALK (0.32) JAK2ALK
SCHEMBL30228042 0.93 ALK (0.32) JAK2ALK
SCHEMBL25624054 0.93 ALK (0.32) JAK2ALK
SCHEMBL25624941 0.91 JAK2 (0.31) JAK2ALK
SCHEMBL25624340 0.91 ALK (0.31) ALK
SCHEMBL25624057 0.86 MAPT (0.35) MAPT
SCHEMBL30228323 0.85 JAK2 (0.33) JAK2MAPTALK
SCHEMBL25624144 0.85 JAK2 (0.33) JAK2MAPTALK
SCHEMBL28998902 0.85 RIPK1 (0.33) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11667649-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-06-06 US disclosed
CN-115916196-A Heteroaromatic macrocyclic ether chemotherapeutic agents 纽威伦特公司 2023-04-04 CN 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 (1 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-11667649-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, PAICS JAK2 688/4885MAPT 3344/4885ALK 1147/4885

“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.