SCHEMBL25867965

SCHEMBL25867965

NN(C(=O)NC1CCCCC1)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
RAB9A P51151 3/20 0.50
MAPT P10636 1/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
EPHX2 P34913 1/20 0.50
ADRA2A P08913 1/20 0.45
PDE4A P27815 1/20 0.45
ADRA1A P35348 1/20 0.45
PKM P14618 1/20 0.44
MMP2 P08253 3/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
MMP8 P22894 1/20 0.42
MMP1 P03956 1/20 0.42

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
SCHEMBL9547549 0.83 EPHX1 (0.54) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22251702 0.79 TSHR (0.38) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL27808066 0.79 TSHR (0.38) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL27808081 0.79 TSHR (0.38) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL22251761 0.77 TSHR (0.35) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL9538240 0.76 EPHX1 (0.50) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL5705094 0.76 EPHX1 (0.50) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL679618 0.76 CCR5 (0.52) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL12506208 0.74 ADRA2A (0.56) EPHX1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL6684532 0.74 EPHX1 (0.48) EPHX1NPC1SMN1; SMN2RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234986-A1 INHIBITORS OF CORONAVIRUS PROTEASE SUNSHINE BIOPHARMA INC. 2023-07-27 US disclosed
US-20230234986-A1 INHIBITORS OF CORONAVIRUS PROTEASE SUNSHINE BIOPHARMA INC. 2023-07-27 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-20230234986-A1 INHIBITORS OF CORONAVIRUS PROTEASE ACE2, ACE, TMPRSS2 EPHX1 2253/4885NPC1 813/4885SMN1; SMN2 4186/4885

“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.