SCHEMBL24673848

SCHEMBL24673848

CC(=O)OC1C[C@H](COC(=O)c2ccccc2)O[C@@H](OC(C)=O)C1OC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
ABCB1 P08183 3/20 0.40
POLB P06746 1/20 0.40
PPM1B O75688 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA5 P30532 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
CES2 O00748 1/20 0.39

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
SCHEMBL22799541 1.00 NPC1 (0.46) NPC1LMNATSHRABCB1POLB
SCHEMBL14404525 0.94 NPC1 (0.46) NPC1ABCB1POLBPPM1B
SCHEMBL8669182 0.94 NPC1 (0.46) NPC1ABCB1POLBPPM1B
SCHEMBL7902225 0.94 NPC1 (0.46) NPC1ABCB1POLBPPM1B
SCHEMBL14593729 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2
SCHEMBL4858609 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2
SCHEMBL29329361 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2
SCHEMBL5385400 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2
SCHEMBL4613728 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2
SCHEMBL14627118 0.92 NPC1 (0.49) NPC1LMNAPOLBPPM1BSMN1; SMN2

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-20220275018-A1 NOVEL SPIROBICYCLIC INTERMEDIATES JANSSEN PHARMACEUTICA NV (BE) 2022-09-01 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-20220275018-A1 NOVEL SPIROBICYCLIC INTERMEDIATES NME2, SLC28A1, SLC28A2 NPC1 398/4885LMNA 742/4885TSHR 3334/4885

“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.