SCHEMBL19257860

SCHEMBL19257860

O=C(NC1C=CC=CC1)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 16/20 0.49
EPHX1 P07099 2/20 0.47
NPC1 O15118 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 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
SCHEMBL3069167 0.77 EPHX2 (0.70) EPHX2EPHX1NPC1KMT2AHSD17B10
SCHEMBL11435229 0.70
SCHEMBL14653231 0.69 SMN1; SMN2 (0.31)
SCHEMBL19798754 0.69 EPHX2 (0.82) EPHX2EPHX1NPC1KMT2AHSD17B10
SCHEMBL12536864 0.66 MAPT (0.40) L3MBTL1
SCHEMBL4113338 0.66 EPHX1 (0.96) EPHX2EPHX1NPC1KMT2AHSD17B10
SCHEMBL15971518 0.66 SMN1; SMN2 (0.37) EPHX1KMT2AL3MBTL1
SCHEMBL7206413 0.65
SCHEMBL653169 0.65 EPHX1 (1.00) EPHX2EPHX1NPC1KMT2AHSD17B10
SCHEMBL3076327 0.64 EPHX2 (0.55) EPHX2EPHX1NPC1KMT2AHSD17B10

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-20170233386-A1 Compounds Which Have a Protective Activity with Respect to the Action of Toxins and of Viruses with an Intracellular Mode of Action COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-08-17 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-20170233386-A1 Compounds Which Have a Protective Activity with Respect to the Action of Toxins and of Viruses with an Intracellular Mode of Action HAVCR2, MAVS, ANTXR2 EPHX2 4690/4885EPHX1 4452/4885NPC1 692/4885

“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.