SCHEMBL27448658

SCHEMBL27448658

CC(CC1CCCN1)NC(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CTSK P43235 7/20 0.41
CTSS P25774 3/20 0.41
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.40
FDPS P14324 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CTSL P07711 2/20 0.37
CTSB P07858 1/20 0.36
EPHX1 P07099 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
SCHEMBL3166275 0.80 CTSK (0.49) CA1CA2CA7CTSKCTSS
SCHEMBL14549364 0.79 FDPS (0.44) CYP2D6KMT2AFDPS
SCHEMBL12203697 0.78 CTSK (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL79825 0.78 EPHX1 (0.44) CYP2D6KMT2AEPHX1
SCHEMBL1268688 0.78 EPHX1 (0.44) CYP2D6KMT2AEPHX1
SCHEMBL145280 0.78 EPHX1 (0.44) CYP2D6KMT2AEPHX1
SCHEMBL25134346 0.78 CCR2 (0.38) CTSKCTSS
SCHEMBL7977167 0.77 FDPS (0.42) CTSKCYP2D6KMT2AFDPSEPHX1
Hydrochloric Acid SCHEMBL2422106 0.77 EPHX1 (0.43) CYP2D6KMT2AEPHX1
Hydrochloric Acid SCHEMBL2417195 0.77 EPHX1 (0.43) CYP2D6KMT2AEPHX1

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-20240216357-A1 POLYCYCLIC COMPOUND AND APPLICATION THEREOF SICHUAN HUIYU PHARMACEUTICAL CO., LTD. (CN) 2024-07-04 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-20240216357-A1 POLYCYCLIC COMPOUND AND APPLICATION THEREOF KDM1A, TET1, KDM3A CA1 698/4885CA2 1660/4885CA7 1449/4885

“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.