SCHEMBL21971395

SCHEMBL21971395

COc1ccc(OC)c(C2N(C)c3ccccc3N2C)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.54
▸ KDM4E B2RXH2 5/20 0.41
▸ NFE2L2 Q16236 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ HIF1A Q16665 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36

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
SCHEMBL21971399 0.85 LMNA (0.47) LMNAKDM4ENFE2L2SMN1; SMN2HIF1A
SCHEMBL21970634 0.84 LMNA (0.59) LMNAKDM4ENFE2L2ALDH1A1HPGD
SCHEMBL21972245 0.78 LMNA (0.53) LMNAKDM4EALDH1A1HPGDMEN1
SCHEMBL21971404 0.76 LMNA (0.58) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL21971000 0.74 LMNA (0.49) LMNAKDM4EHIF1AALDH1A1NPC1
SCHEMBL12978570 0.73 LMNA (0.69) LMNAKDM4EALDH1A1HPGDMEN1
SCHEMBL29414076 0.73 LMNA (0.69) LMNAKDM4EALDH1A1HPGDMEN1
SCHEMBL20739825 0.72 LMNA (0.54) LMNAKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL20739823 0.69 LMNA (0.50) LMNAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL20637698 0.66 KDM4E (0.47) LMNAKDM4EALDH1A1HPGDMEN1

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 4733/4885KDM4E 4526/4885NFE2L2 2086/4885
US-11046655-B2 Compound and method for producing same CBR3, NR5A1, NR2E3 LMNA 4570/4885KDM4E 4760/4885NFE2L2 1966/4885

“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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