SCHEMBL21523101

SCHEMBL21523101

NC(COC(=O)c1cccnc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.63
▸ TDP1 Q9NUW8 3/20 0.63
▸ KMT2A Q03164 2/20 0.63
▸ ALDH1A1 P00352 6/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ EPHX2 P34913 2/20 0.49
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ PLOD2 O00469 1/20 0.48
▸ TSHR P16473 1/20 0.46
▸ APP P05067 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HCAR3 P49019 1/20 0.46
▸ HCAR2 Q8TDS4 1/20 0.46

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
SCHEMBL21523100 1.00 LMNA (0.63) LMNATDP1KMT2AALDH1A1KDM4E
SCHEMBL25437225 0.86 ALDH1A1 (0.45) LMNATDP1KMT2AALDH1A1KDM4E
SCHEMBL28117942 0.85 ALDH1A1 (0.62) LMNATDP1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL21523076 0.79 LMNA (0.48) LMNATDP1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL21523059 0.78 LMNA (0.50) LMNATDP1KMT2AALDH1A1KDM4E
Hydrochloric Acid SCHEMBL21523057 0.78 LMNA (0.50) LMNATDP1KMT2AALDH1A1KDM4E
Benzyl Nicotinate SCHEMBL29394048 0.78 LMNA (1.00) LMNATDP1KMT2AALDH1A1KDM4E
Benzyl Nicotinate SCHEMBL24600 0.78 LMNA (1.00) LMNATDP1KMT2AALDH1A1KDM4E
SCHEMBL4203340 0.78 L3MBTL1 (0.61) LMNATDP1KMT2AALDH1A1KDM4E
SCHEMBL28171223 0.78 LMNA (0.59) LMNATDP1KMT2AALDH1A1KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190330141-A1 Compositions With A Cooling Effect THE PROCTER & GAMBLE COMPANY 2019-10-31 — — 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 (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-20190330141-A1 Compositions With A Cooling Effect CUTA, FABP4, EBP LMNA 1778/4885TDP1 2582/4885KMT2A 3449/4885

“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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