SCHEMBL24828323

SCHEMBL24828323

CCn1cc(Cn2ncnc2Br)c(C)n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 4/20 0.33
POLB P06746 3/20 0.33
COMT P21964 1/20 0.33
RECQL P46063 2/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 3/20 0.31
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 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
SCHEMBL24828634 0.85 ADORA3 (0.32)
SCHEMBL24828656 0.83 LMNA (0.32) LMNA
SCHEMBL16321601 0.71
SCHEMBL1361978 0.69 L3MBTL1 (0.62) L3MBTL1LMNASMN1; SMN2HTTRAB9A
SCHEMBL24828432 0.69 LMNA (0.34) L3MBTL1LMNASMN1; SMN2HTTRAB9A
SCHEMBL24828383 0.68 HTT (0.30) HTT
SCHEMBL24828541 0.67 L3MBTL1 (0.59) L3MBTL1LMNASMN1; SMN2HTTRAB9A
SCHEMBL12094466 0.67 L3MBTL1 (0.64) L3MBTL1LMNASMN1; SMN2HTTRAB9A
SCHEMBL15634894 0.67 L3MBTL1 (0.54) L3MBTL1LMNASMN1; SMN2HTTRAB9A
SCHEMBL24828320 0.67 L3MBTL1 (0.54) L3MBTL1LMNASMN1; SMN2HTTRAB9A

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-20240352037-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT, INC. 2024-10-24 US disclosed
US-12054498-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2024-08-06 US disclosed
US-20230107663-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT, INC. 2023-04-06 US disclosed
US-11542278-B1 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-01-03 US disclosed
US-11542278-B1 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-01-03 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 (4 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-20240352037-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS ABCB1, CYP2C8, PAICS L3MBTL1 3638/4885LMNA 2145/4885SMN1; SMN2 1858/4885
US-12054498-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, CYP3A43 L3MBTL1 4110/4885LMNA 2258/4885SMN1; SMN2 2005/4885
US-11542278-B1 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, CYP3A43 L3MBTL1 4110/4885LMNA 2258/4885SMN1; SMN2 2005/4885
US-20230107663-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS ABCB1, CYP2C8, PAICS L3MBTL1 3638/4885LMNA 2145/4885SMN1; SMN2 1858/4885

“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.