SCHEMBL17838781

SCHEMBL17838781

CCCCNC(=O)C1(O)C[C@@H](O)C(O)[C@H](O)C1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
EPHX1 P07099 2/20 0.39
EPHX2 P34913 3/20 0.38
SPHK1 Q9NYA1 6/20 0.38
FUCA1 P04066 1/20 0.37
ACHE P22303 1/20 0.37
MMP2 P08253 1/20 0.37

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
SCHEMBL17838782 1.00 KMT2A (0.41) KMT2AEPHX1EPHX2SPHK1FUCA1
SCHEMBL595423 0.90 MEN1 (0.39) KMT2AEPHX1EPHX2MMP2
SCHEMBL10001421 0.90 MEN1 (0.39) KMT2AEPHX1EPHX2MMP2
SCHEMBL17838788 0.80 KMT2A (0.37) KMT2AEPHX1EPHX2SPHK1FUCA1
SCHEMBL16408935 0.78 EPHX2 (0.41) KMT2AEPHX2
SCHEMBL21941459 0.73 SPHK1 (0.54) EPHX1SPHK1
SCHEMBL8269540 0.72 TRPV1 (0.41) KMT2AEPHX2
SCHEMBL16408932 0.72 THRB (0.34)
SCHEMBL26017783 0.72 SPHK1 (0.57) EPHX1SPHK1
SCHEMBL17702625 0.69 KMT2A (0.70) KMT2AEPHX2

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-10369133-B2 Immunosuppressive compounds and therapeutics THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2019-08-06 US disclosed
US-20160175281-A1 IMMUNOSUPPRESSIVE COMPOUNDS AND THERAPEUTICS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-23 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-10369133-B2 Immunosuppressive compounds and therapeutics NFATC1, ICOS, TSLP KMT2A 2758/4885EPHX1 1261/4885EPHX2 2887/4885
US-20160175281-A1 IMMUNOSUPPRESSIVE COMPOUNDS AND THERAPEUTICS NFATC1, ICOS, TSLP KMT2A 2758/4885EPHX1 1261/4885EPHX2 2887/4885

“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.