SCHEMBL8408205

SCHEMBL8408205

CN1C(=O)[C@@H](O)[C@@H](c2ccccc2)[C@H]1O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
TSHR P16473 2/20 0.40
HDAC4 P56524 5/20 0.39
HDAC3 O15379 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
HDAC6 Q9UBN7 1/20 0.39
MEN1 O00255 2/20 0.38
MAN2B1 O00754 1/20 0.38
EPHX2 P34913 1/20 0.36
BRD4 O60885 3/20 0.36
HSD17B2 P37059 1/20 0.36

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
SCHEMBL8508684 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL6837104 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL8509434 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL8486054 0.77 MEN1 (0.42) KMT2AMEN1MAN2B1HSD17B2
SCHEMBL8168467 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL6837215 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL8173575 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
SCHEMBL9679048 0.77 EPHX1 (0.39) KMT2AHDAC4HDAC3HDAC7HDAC8
(+)Clausenamide SCHEMBL6836959 0.76 HSD17B2 (0.55) MAN2B1HSD17B2
(+)Clausenamide SCHEMBL8168700 0.76 HSD17B2 (0.55) MAN2B1HSD17B2

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-20030207935-A1 Novel optically active clausenamides, process of the preparation thereof, pharmaceutical composition containing the same and their medical use INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES 2003-11-06 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-20030207935-A1 Novel optically active clausenamides, process of the preparation thereof, pharmaceutical composition containing the same and their medical use HIF1AN, HIF1A, CLN6 KMT2A 2709/4885TSHR 4724/4885HDAC4 998/4885

“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.