SCHEMBL22388985

SCHEMBL22388985

CCNC(=O)OCc1ccc(NCC)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PRSS1 P07477 1/20 0.43
TPSAB1 Q15661 1/20 0.43
TPSD1 Q9BZJ3 1/20 0.43
TPSG1 Q9NRR2 1/20 0.43
HTT P42858 1/20 0.42
NAMPT P43490 1/20 0.42
ALDH1A1 P00352 1/20 0.41
NAAA Q02083 1/20 0.41
PDE4A P27815 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL24760208 0.89 L3MBTL1 (0.48) L3MBTL1MAPTSMN1; SMN2LMNAMEN1
SCHEMBL18430370 0.87 L3MBTL1 (0.45) L3MBTL1MAPTSMN1; SMN2LMNAMEN1
SCHEMBL24760348 0.86 CTSK (0.46) LMNAMEN1KMT2APRSS1TPSAB1
SCHEMBL24760365 0.84 KCNA5 (0.47) L3MBTL1MAPTSMN1; SMN2LMNACTSK
SCHEMBL19001575 0.83 CTSK (0.44) L3MBTL1MAPTSMN1; SMN2LMNAMEN1
SCHEMBL17448273 0.83 CTSK (0.49) L3MBTL1MAPTSMN1; SMN2LMNAMEN1
SCHEMBL15499765 0.83 ALDH1A1 (0.56) L3MBTL1MAPTSMN1; SMN2LMNAMEN1
SCHEMBL13684290 0.83 NAAA (0.51) L3MBTL1MAPTSMN1; SMN2LMNAPRSS1
SCHEMBL25062103 0.83 TOP2A (0.49) LMNAMEN1KMT2APRSS1TPSAB1
SCHEMBL22388944 0.83 LMNA (0.45) L3MBTL1MAPTSMN1; SMN2LMNAMEN1

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
WO-2022262789-A1 ANTITUMOR COMPOUND AND USE THEREOF 明慧医药(杭州)有限公司 2022-12-22 WO disclosed
US-20200276261-A1 A CONJUGATE OF A TUBULYSIN ANALOG WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2020-09-03 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-20200276261-A1 A CONJUGATE OF A TUBULYSIN ANALOG WITH BRANCHED LINKERS TEKT1, TEK, BTN3A1 L3MBTL1 1087/4885MAPT 2764/4885SMN1; SMN2 3844/4885

“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.