SCHEMBL23975143

SCHEMBL23975143

O=C(NCCOCCOCCNC1CCCC1)C1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 1/20 0.48
PKM P14618 1/20 0.48
EPHX2 P34913 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
CHRM1 P11229 3/20 0.44
NAAA Q02083 1/20 0.44
EPHX1 P07099 1/20 0.42
HSD17B10 Q99714 1/20 0.41
FOXM1 Q08050 2/20 0.41
KDM4E B2RXH2 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CXCR4 P61073 1/20 0.38

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
SCHEMBL23975357 0.98 SMN1; SMN2 (0.50) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL26158778 0.94 SMN1; SMN2 (0.48) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL23975365 0.90 SMN1; SMN2 (0.44) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL21842360 0.90 SMN1; SMN2 (0.44) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL23975361 0.90 SMN1; SMN2 (0.44) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL24244844 0.88 SMN1; SMN2 (0.58) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL23975359 0.84 NAAA (0.50) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL21842289 0.84 NAAA (0.50) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL23975140 0.84 NAAA (0.50) SMN1; SMN2NPC1PKMEPHX2RAB9A
SCHEMBL16127048 0.80 SMN1; SMN2 (0.54) SMN1; SMN2NPC1PKMEPHX2RAB9A

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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-11-04 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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN HAVCR2, CUL4A, PSMC3 SMN1; SMN2 3617/4885NPC1 734/4885PKM 3807/4885

“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.