SCHEMBL20076474

SCHEMBL20076474

CCCCCCC(C)(CC)CCCC(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.50
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PAM P19021 2/20 0.46
CYP1A2 P05177 1/20 0.46
TSHR P16473 1/20 0.44
LMNA P02545 2/20 0.42
DNM1 Q05193 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.41
DUSP3 P51452 1/20 0.41
GAA P10253 1/20 0.41
LPAR6 P43657 1/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR4 Q99677 1/20 0.40
LPAR5 Q9H1C0 1/20 0.40
LPAR2 Q9HBW0 1/20 0.40

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
SCHEMBL20198651 0.93 MAPT (0.46) DGKAMAPTMEN1KMT2AATM
SCHEMBL20076483 0.93 CYP1A2 (0.48) DGKAMAPTMEN1KMT2AATM
SCHEMBL19861446 0.86 DGKA (0.53) DGKAMAPTMEN1KMT2AATM
SCHEMBL19645199 0.85 MEN1 (0.47) DGKAMAPTMEN1KMT2AATM
SCHEMBL20076183 0.85 MAPT (0.47) DGKAMAPTMEN1KMT2AATM
SCHEMBL20076307 0.82 CYP1A2 (0.52) DGKAMAPTL3MBTL1PAMCYP1A2
SCHEMBL8322451 0.80 DGKA (0.75) DGKAMAPTMEN1KMT2APAM
Hexane SCHEMBL3138126 0.80 DGKA (0.75) DGKAMAPTMEN1KMT2APAM
SCHEMBL5448566 0.80 DGKA (0.75) DGKAMAPTMEN1KMT2APAM
SCHEMBL454 0.80 DGKA (0.75) DGKAMAPTMEN1KMT2APAM

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-10647747-B2 Cyclosporin derivatives and uses thereof S&T GLOBAL INC. (US) 2020-05-12 US disclosed
US-20180105558-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2018-04-19 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-10647747-B2 Cyclosporin derivatives and uses thereof FKBP5, FKBP1B, MALT1 DGKA 4006/4885MAPT 1415/4885MEN1 523/4885
US-20180105558-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF FKBP1B, MALT1, FKBP5 DGKA 4049/4885MAPT 1874/4885MEN1 786/4885

“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.