SCHEMBL21844115

SCHEMBL21844115

CC(C)(C)OC(=O)N[C@@]1(C)CCC(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
RORC P51449 1/20 0.35
GHSR Q92847 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
MAPK10 P53779 1/20 0.34
ALDH1A1 P00352 1/20 0.32
CTSL P07711 1/20 0.32
BACE1 P56817 1/20 0.31
P2RX7 Q99572 1/20 0.31
SPR P35270 1/20 0.31
PPIA P62937 1/20 0.31
BUB1 O43683 1/20 0.31

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
SCHEMBL25521432 0.91 GAA (0.39) GAANFKB1NFKB2RELARORC
SCHEMBL3206281 0.90 GAA (0.39) GAANFKB1NFKB2RELARORC
SCHEMBL23274329 0.86 GAA (0.44) GAANFKB1NFKB2RELARORC
SCHEMBL31214681 0.79 GHSR (0.41) GAANFKB1NFKB2RELAGHSR
SCHEMBL2087734 0.79 RORC (0.43) GAANFKB1NFKB2RELARORC
SCHEMBL26012490 0.78 GAA (0.36) GAANFKB1NFKB2RELARORC
SCHEMBL8859492 0.77 GHSR (0.39) GAANFKB1NFKB2RELAGHSR
SCHEMBL31563833 0.77 GHSR (0.38) GAANFKB1NFKB2RELARORC
SCHEMBL18424709 0.75 RORC (0.39) GAANFKB1NFKB2RELARORC
SCHEMBL17520236 0.75 RORC (0.39) GAANFKB1NFKB2RELARORC

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230062975-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS SPRING MILL PHARMA, INC. 2023-03-02 US disclosed
US-11014881-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2021-05-25 US disclosed
US-20200123105-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS SPRING MILL PHARMA, INC. 2020-04-23 US disclosed
US-10590076-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2020-03-17 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 (4 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-20200123105-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP GAA 1088/4885NFKB1 459/4885NFKB2 396/4885
US-20230062975-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP GAA 1088/4885NFKB1 459/4885NFKB2 396/4885
US-10590076-B2 Hepatitis B capsid assembly modulators HAVCR2, COPB1, HDLBP GAA 1088/4885NFKB1 459/4885NFKB2 396/4885
US-11014881-B2 Hepatitis B capsid assembly modulators HAVCR2, COPB1, HDLBP GAA 1088/4885NFKB1 459/4885NFKB2 396/4885

“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.