SCHEMBL17364296

SCHEMBL17364296

O=C(Nc1ccc(Cl)cc1)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.46
SLC9A3 P48764 3/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
ATM Q13315 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
KLK7 P49862 2/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CNR1 P21554 1/20 0.41
TSHR P16473 1/20 0.40
POLB P06746 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
SCHEMBL16785946 0.84 PDE4A (0.42) PDE4ASLC9A3MEN1KMT2AKLK7
SCHEMBL17364325 0.84 KMT2A (0.44) PDE4AMEN1KMT2ANPC1GAA
SCHEMBL8058913 0.84 PDE4A (0.48) PDE4ASLC9A3MEN1KMT2ANPC1
SCHEMBL29051509 0.83 PDE4A (0.44) PDE4AMEN1KMT2ALMNAALDH1A1
SCHEMBL30498890 0.83 PDE4A (0.44) PDE4AMEN1KMT2ALMNAALDH1A1
SCHEMBL18872551 0.82 PDE4A (0.40) PDE4ASLC9A3MEN1KMT2ALMNA
SCHEMBL11114702 0.82 KMT2A (0.55) MEN1KMT2ANPC1KLK7ALDH1A1
SCHEMBL16788260 0.82 KMT2A (0.55) MEN1KMT2ANPC1KLK7ALDH1A1
SCHEMBL9614867 0.81 NPC1 (0.57) PDE4AMEN1KMT2ANPC1GAA
SCHEMBL7196074 0.81 MAPT (0.48) PDE4AMEN1KMT2ANPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10004222-B2 Small molecule ice recrystallization inhibitors and methods of use thereof THE UNIVERSITY OF OTTAWA (CA) 2018-06-26 US claimed
US-20150373968-A1 Small Molecule Ice Recrystallization Inhibitors And Methods Of Use Thereof THE UNIVERSITY OF OTTAWA (CA) 2015-12-31 US claimed
US-20240268372-A1 Methods and Compositions for Extending Organ and Tissue Preservation MASSACHUSETTS GEN HOSPITAL (US) 2024-08-15 US disclosed
WO-2022241417-A1 METHODS AND COMPOSITIONS FOR EXTENDING ORGAN AND TISSUE PRESERVATION THE GENERAL HOSPITAL CORPORATION (US) 2022-11-17 WO disclosed
US-10004222-B2 Small molecule ice recrystallization inhibitors and methods of use thereof THE UNIVERSITY OF OTTAWA (CA) 2018-06-26 US disclosed
US-10004222-B2 Small molecule ice recrystallization inhibitors and methods of use thereof THE UNIVERSITY OF OTTAWA (CA) 2018-06-26 US disclosed
US-20150373968-A1 Small Molecule Ice Recrystallization Inhibitors And Methods Of Use Thereof THE UNIVERSITY OF OTTAWA (CA) 2015-12-31 US disclosed
US-20150373968-A1 Small Molecule Ice Recrystallization Inhibitors And Methods Of Use Thereof THE UNIVERSITY OF OTTAWA (CA) 2015-12-31 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 (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-10004222-B2 Small molecule ice recrystallization inhibitors and methods of use thereof MCL1, IDH3B, IDH3A PDE4A 4090/4885SLC9A3 3046/4885MEN1 4758/4885
US-20150373968-A1 Small Molecule Ice Recrystallization Inhibitors And Methods Of Use Thereof MCL1, DCX, IDH3B PDE4A 3718/4885SLC9A3 3257/4885MEN1 4851/4885

“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.