SCHEMBL19400283

SCHEMBL19400283

CCC(=O)NCCCCCCCC(=O)O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
ADRA1A P35348 1/20 0.64
PRMT1 Q99873 1/20 0.63
EPHX2 P34913 8/20 0.60
PLA2G2A P14555 1/20 0.58
CASP2 P42575 1/20 0.53
PLA2G4A P47712 1/20 0.53
PPARG P37231 3/20 0.52
PPARD Q03181 3/20 0.52
PPARA Q07869 3/20 0.52
TSHR P16473 2/20 0.52
GPR84 Q9NQS5 2/20 0.52
HDAC11 Q96DB2 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
ALDH1A1 P00352 1/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
TLR2 O60603 1/20 0.52
ESR1 P03372 1/20 0.52

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
SCHEMBL19400289 1.00 MEN1 (0.71) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL20009655 1.00 MEN1 (0.71) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL9265462 1.00 MEN1 (0.71) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL5522638 1.00 MEN1 (0.71) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL45902 0.98 MEN1 (0.74) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL1912627 0.91 MEN1 (0.70) MEN1KMT2AADRA1APRMT1EPHX2
SCHEMBL11758762 0.87 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1
SCHEMBL21765846 0.87 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1
SCHEMBL9259257 0.87 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1
SCHEMBL9262199 0.86 CASP2 (0.74) MEN1KMT2AADRA1APRMT1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919926-B2 Compound or salt thereof, natural killer T cell activator, and pharmaceutical composition KEIO UNIVERSITY (JP) 2021-02-16 US disclosed
US-10919926-B2 Compound or salt thereof, natural killer T cell activator, and pharmaceutical composition KEIO UNIVERSITY (JP) 2021-02-16 US disclosed
US-20200207798-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION KEIO UNIVERSITY (JP) 2020-07-02 US disclosed
US-20200207798-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION KEIO UNIVERSITY (JP) 2020-07-02 US disclosed
EP-3434684-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION Keio University (JP) 2019-01-30 EP disclosed
EP-3434684-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION Keio University (JP) 2019-01-30 EP disclosed
WO-2017163808-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION 学校法人慶應義塾 2017-09-28 WO 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-20200207798-A1 COMPOUND OR SALT THEREOF, NATURAL KILLER T CELL ACTIVATOR, AND PHARMACEUTICAL COMPOSITION CD4, NFATC1, PBK MEN1 974/4885KMT2A 222/4885ADRA1A 397/4885
US-10919926-B2 Compound or salt thereof, natural killer T cell activator, and pharmaceutical composition CD4, NFATC1, PBK MEN1 786/4885KMT2A 99/4885ADRA1A 399/4885

“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.