SCHEMBL16593142

SCHEMBL16593142

CCC(=O)NCCCCC(C)C(C)=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ CASP2 P42575 1/20 0.40
▸ RECQL P46063 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ FAAH O00519 1/20 0.39
▸ NAAA Q02083 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CA1 P00915 1/20 0.37
▸ EPHX1 P07099 1/20 0.37
▸ PAOX Q6QHF9 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
SCHEMBL25608711 0.86 MEN1 (0.52) MEN1KMT2ARECQLALDH1A1
SCHEMBL20900404 0.85 MEN1 (0.63) MEN1KMT2ACASP2RECQLNAAA
SCHEMBL14217283 0.85 MEN1 (0.63) MEN1KMT2ACASP2RECQLNAAA
SCHEMBL71906 0.84 MEN1 (0.45) MEN1KMT2ARECQLFAAH
SCHEMBL13805651 0.84 MEN1 (0.45) MEN1KMT2ACASP2RECQLNAAA
SCHEMBL14086890 0.82 KMT2A (0.71) MEN1KMT2ACASP2RECQLNAAA
SCHEMBL21041793 0.82 KDM4E (0.60) MEN1KMT2AKDM4EMAPK1HIF1A
SCHEMBL14644875 0.82 KDM4E (0.60) MEN1KMT2AKDM4EMAPK1HIF1A
SCHEMBL12092856 0.82 MEN1 (0.59) MEN1KMT2ACASP2RECQLNAAA
SCHEMBL21563328 0.82 CASP2 (0.59) MEN1KMT2ACASP2MAPK1FAAH

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-9783578-B2 Immunosuppression modulating compounds AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-10-10 — — US disclosed
US-20150087581-A1 Immunosuppression Modulating Compounds AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-03-26 — — 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-20150087581-A1 Immunosuppression Modulating Compounds CD274, PDCD1, PDCD1LG2 MEN1 1868/4885KMT2A 3620/4885CASP2 1297/4885

“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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