SCHEMBL21972258

SCHEMBL21972258

COc1cc(N(C)C)c(C2N(C)c3ccccc3N2C)c(N(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ PDGFRB P09619 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.38
▸ SLC16A3 O15427 1/20 0.35
▸ SLC16A1 P53985 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SNCA P37840 1/20 0.33
▸ BRD4 O60885 1/20 0.32
▸ BRPF1 P55201 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HRH1 P35367 1/20 0.32
▸ SMPD1 P17405 1/20 0.32
▸ CA4 P22748 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
SCHEMBL21972255 0.91 LMNA (0.42) LMNAPDGFRBKDM4ESLC16A3SLC16A1
SCHEMBL21972251 0.91 LMNA (0.49) LMNAPDGFRBKDM4ESLC16A3SLC16A1
SCHEMBL21972261 0.88 LMNA (0.40) LMNAPDGFRBKDM4ESLC16A3SLC16A1
SCHEMBL21972266 0.82 LMNA (0.49) LMNAPDGFRBKDM4EHTTMEN1
SCHEMBL20739438 0.82 PDGFRB (0.57) LMNAPDGFRBKDM4EHTTMEN1
SCHEMBL21971005 0.82 LMNA (0.51) LMNAPDGFRBKDM4EHTTMEN1
SCHEMBL21971004 0.80 PDGFRB (0.53) LMNAPDGFRBKDM4EHTTMEN1
SCHEMBL21972250 0.79 PDGFRB (0.46) LMNAPDGFRBKDM4EHTTMEN1
SCHEMBL21971001 0.79 LMNA (0.51) LMNAPDGFRBKDM4ESLC16A3SLC16A1
SCHEMBL21971404 0.79 LMNA (0.58) LMNAPDGFRBKDM4EHTTMEN1

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-11046655-B2 Compound and method for producing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 — — US disclosed
US-20200140394-A1 NOVEL COMPOUND AND METHOD FOR PRODUCING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-07 — — 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-20200140394-A1 NOVEL COMPOUND AND METHOD FOR PRODUCING SAME CBR3, NR2E3, NR5A2 LMNA 4733/4885PDGFRB 2517/4885KDM4E 4526/4885
US-11046655-B2 Compound and method for producing same CBR3, NR5A1, NR2E3 LMNA 4570/4885PDGFRB 2499/4885KDM4E 4760/4885

“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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