SCHEMBL20975234

SCHEMBL20975234

C/C=C\c1nc(N)c2ncn(CCCCOC(=O)NCc3ccc(S(=O)(=O)NCc4ccc(C)cc4)cc3)c2n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.39
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ NAMPT P43490 2/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ USP2 O75604 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL20946430 0.94 HDAC1 (0.37) MEN1KMT2ATP53NAMPTCA1
SCHEMBL20972809 0.90 LMNA (0.42) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20975301 0.88 LMNA (0.42) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL26222479 0.88 LMNA (0.41) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20972933 0.87 LMNA (0.42) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20975131 0.87 ALDH1A1 (0.40) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20975399 0.87 LMNA (0.43) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20974372 0.86 LMNA (0.41) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20974411 0.86 CTSL (0.39) LMNAMEN1KMT2ATP53NAMPT
SCHEMBL20975154 0.85 LMNA (0.39) LMNAMEN1KMT2ATP53NAMPT

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-11236093-B2 Adenine derivatives as protein kinase inhibitors B.C.I. PHARMA (BE) 2022-02-01 — — US disclosed
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2019-05-02 — — 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 (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-11236093-B2 Adenine derivatives as protein kinase inhibitors ADK, TNNI3K, TNK2 LMNA 873/4885MEN1 3778/4885KMT2A 1296/4885
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS ADK, TNNI3K, TNK2 LMNA 873/4885MEN1 3778/4885KMT2A 1296/4885

“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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