SCHEMBL29325164

SCHEMBL29325164

C=CCOc1ccc(-c2ccc(OC(=O)CC(=O)Oc3ccc(-c4ccc(OCC=C)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ BACE1 P56817 1/20 0.45
▸ CHRNB2 P17787 4/20 0.45
▸ CHRNB4 P30926 4/20 0.45
▸ CHRNA3 P32297 4/20 0.45
▸ CHRNA4 P43681 4/20 0.45
▸ CYP2D6 P10635 1/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ SLC5A1 P13866 1/20 0.42
▸ SLC5A2 P31639 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41

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
SCHEMBL19724336 0.85 THRB (0.50) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL7531617 0.84 NPC1 (0.48) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL10538989 0.83 HSD17B10 (0.53) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL18688508 0.82 THRB (0.42) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL472165 0.82 CA12 (0.57) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL9065504 0.82 CA12 (0.57) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL11261082 0.81 SMN1; SMN2 (0.54) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL29168890 0.80 CA12 (0.53) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL29168891 0.79 CA12 (0.51) NPC1MAPTRAB9APOLBSMN1; SMN2
SCHEMBL27460918 0.79 GAA (0.50) NPC1MAPTRAB9APOLBSMN1; 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-20240239949-A1 MULTIFUNCTIONAL EPOXY COMPOUND HAVING MULTIPLE LIQUID CRYSTAL CORES, AND CURED PRODUCT PRODUCED THEREFROM KYUNGPOOK NATIONAL UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2024-07-18 — — 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-20240239949-A1 MULTIFUNCTIONAL EPOXY COMPOUND HAVING MULTIPLE LIQUID CRYSTAL CORES, AND CURED PRODUCT PRODUCED THEREFROM ALOX5, ALOX5AP, THEM6 NPC1 4121/4885MAPT 1139/4885RAB9A 3736/4885

“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.

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