SCHEMBL9945570

SCHEMBL9945570

CC/C(C)=N/OCCN1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 11/20 0.40
PSMB5 P28074 10/20 0.40
PSMB2 P49721 7/20 0.40
KDM4E B2RXH2 1/20 0.38
ESR1 P03372 3/20 0.37
LMNA P02545 1/20 0.35
LTA4H P09960 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL6979246 0.84 GAA (0.43) PSMB1PSMB5KDM4ELMNA
SCHEMBL6976865 0.84 PSMB1 (0.36) PSMB1PSMB5PSMB2KDM4ELMNA
SCHEMBL13151498 0.83 PSMB1 (0.41) PSMB1PSMB5PSMB2KDM4ELMNA
SCHEMBL9975277 0.83 PSMB1 (0.41) PSMB1PSMB5PSMB2KDM4ELMNA
Hydrochloric Acid SCHEMBL28035282 0.81 PSMB1 (0.41) PSMB1PSMB5PSMB2KDM4ELMNA
SCHEMBL6978681 0.81 PSMB1 (0.39) PSMB1PSMB5PSMB2KDM4ELMNA
SCHEMBL6978964 0.81 PSMB1 (0.35) PSMB1PSMB5PSMB2KDM4ELTA4H
SCHEMBL6979435 0.80 TACR1 (0.35)
SCHEMBL16837520 0.79 PSMB1 (0.38) PSMB1PSMB5PSMB2KDM4E
SCHEMBL9944262 0.79 PSMB1 (0.43) PSMB1PSMB5PSMB2KDM4ELMNA

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-20120149707-A1 ALPHA-ARYLMETHOXYACRYLATE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME OSCOTEC INC. (KR) 2012-06-14 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-20120149707-A1 ALPHA-ARYLMETHOXYACRYLATE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME HIF1A, HIF1AN, EGLN3 PSMB1 302/4885PSMB5 585/4885PSMB2 655/4885

“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.