SCHEMBL21972257

SCHEMBL21972257

COc1cc(N(C)C)cc(C)c1C1N(C)c2ccccc2N1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.49
▸ PDGFRB P09619 1/20 0.48
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ GLA P06280 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ HTR1A P08908 5/20 0.33
▸ NQO2 P16083 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL20739825 0.91 LMNA (0.54) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21972266 0.86 LMNA (0.49) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21972265 0.83 LMNA (0.46) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21972251 0.78 LMNA (0.49) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21972255 0.78 LMNA (0.42) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21971404 0.77 LMNA (0.58) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL20739761 0.77 CRHR1 (0.36) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL21971009 0.77 LMNA (0.63) LMNAPDGFRBMEN1KMT2AKDM4E
SCHEMBL20739824 0.77 LMNA (0.36) LMNAPDGFRBKDM4EALDH1A1GLA
SCHEMBL21972245 0.76 LMNA (0.53) LMNAMEN1KMT2AKDM4EALDH1A1

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 2517/4885MEN1 1897/4885
US-11046655-B2 Compound and method for producing same CBR3, NR5A1, NR2E3 LMNA 4570/4885PDGFRB 2499/4885MEN1 1027/4885

“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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