SCHEMBL30718031

SCHEMBL30718031

C=C[C@](N)(CO)[C@H](O)CCCCCCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.41
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
GMNN O75496 2/20 0.41
POLB P06746 2/20 0.41
BLM P54132 2/20 0.41
MAPT P10636 2/20 0.41
CETP P11597 2/20 0.41
UBE2N P61088 2/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTT P42858 1/20 0.41
GPR84 Q9NQS5 7/20 0.35
FFAR1 O14842 1/20 0.35
LAP3 P28838 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL9116836 1.00 SPHK1 (0.41) SPHK1LMNACYP2D6GMNNPOLB
Phosphoric Acid SCHEMBL9117264 0.92 LAP3 (0.42) LAP3
SCHEMBL27683561 0.77 LMNA (0.39) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL6915675 0.76 SGPL1 (0.44)
SCHEMBL28235625 0.74 CYP2D6 (0.46) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL4008504 0.73 SPHK1 (0.50) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL5671085 0.73 SPHK1 (0.50) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL10944400 0.73 SPHK1 (0.50) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL10944404 0.73 SPHK1 (0.50) SPHK1LMNACYP2D6GMNNPOLB
SCHEMBL8499519 0.71 FFAR4 (0.46) SPHK1LMNACYP2D6GMNNPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11850234-B2 Enhancement of cancer treatment efficiency via the sphingosine-1-phosphate pathway AC BIOSCIENCE (CH) 2023-12-26 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-11850234-B2 Enhancement of cancer treatment efficiency via the sphingosine-1-phosphate pathway SPHK1, S1PR1, S1PR2 SPHK1 1/4885LMNA 2845/4885CYP2D6 4602/4885

“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.