SCHEMBL24137482

SCHEMBL24137482

O=c1ccc(-c2cncc(NCc3ccccc3)c2)c[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.46
▸ METAP2 P50579 1/20 0.45
▸ CYP11B2 P19099 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ EGFR P00533 1/20 0.43
▸ PIK3CA P42336 1/20 0.43
▸ SCN2A Q99250 1/20 0.42
▸ SCN10A Q9Y5Y9 1/20 0.42
▸ AKT1 P31749 1/20 0.41
▸ IP6K1 Q92551 1/20 0.41
▸ XDH P47989 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ BRAF P15056 1/20 0.40
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL13743125 0.80 KCNH2 (0.56) KCNH2METAP2CYP11B2KDREGFR
SCHEMBL24137564 0.80 PKM (0.49) KCNH2CYP11B2KDREGFRPIK3CA
SCHEMBL30596234 0.80 PKM (0.49) KCNH2CYP11B2KDREGFRPIK3CA
SCHEMBL24137514 0.79 VNN1 (0.48) XDHMEN1KMT2A
SCHEMBL22191227 0.79 PDE3B (0.47) KCNH2CYP11B2KDREGFRPIK3CA
SCHEMBL28563905 0.77 KCNH2 (0.51) KCNH2METAP2CYP11B2KDREGFR
SCHEMBL4932096 0.76 KCNH2 (0.53) KCNH2METAP2CYP11B2KDRAKT1
SCHEMBL22191691 0.74 PLK4 (0.48) KCNH2KDREGFRPIK3CAAKT1
SCHEMBL24137565 0.74 KCNH2 (0.47) KCNH2METAP2KDRIP6K1ALDH1A1
SCHEMBL22191277 0.74 CDK2 (0.60) CYP11B2AKT1

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-20230234935-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2023-07-27 — — US disclosed
US-20230234935-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2023-07-27 — — US disclosed
WO-2021263129-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2021-12-30 — — 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 (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-20230234935-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE PACSIN2, MAP3K20, PHKG1 KCNH2 718/4885METAP2 1643/4885CYP11B2 3253/4885

“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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