SCHEMBL27092032

SCHEMBL27092032

O=COc1c2ccccc2nc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.55
▸ KDM4E B2RXH2 7/20 0.53
▸ GLA P06280 5/20 0.53
▸ MAPT P10636 3/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM1A O60341 2/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ MAOA P21397 2/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ CASP7 P55210 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ CHRM2 P08172 1/20 0.45
▸ ADRA2A P08913 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ CHRM1 P11229 1/20 0.45
▸ NQO2 P16083 1/20 0.45
▸ DRD1 P21728 1/20 0.45
▸ ACHE P22303 1/20 0.45

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
SCHEMBL7500303 0.77 POLB (0.53) POLBKDM4EALDH1A1TDP1GAA
SCHEMBL17423220 0.75 KDM4E (0.78) POLBKDM4EGLAMAPTKMT2A
SCHEMBL16851823 0.74 ERN1 (0.58) POLBKDM4EGLAMAPTKMT2A
SCHEMBL12136237 0.73 LMNA (0.51) KDM4EMAPTKMT2AALDH1A1HPGD
SCHEMBL4957187 0.72 POLB (0.57) POLBKDM4EGLAMAPTKMT2A
SCHEMBL3042274 0.71 ERN1 (0.61) POLBKDM4EGLAMAPTKMT2A
SCHEMBL1408391 0.71 POLB (1.00) POLBKDM4EGLAMAPTKMT2A
SCHEMBL5183047 0.71 POLB (0.55) POLBKDM4EGLAMAPTKMT2A
SCHEMBL222907 0.71 ALDH1A1 (0.50) POLBKDM4EGLAMAPTKMT2A
SCHEMBL28746938 0.71 ERN1 (0.45) POLBMAPTKMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024163598-A2 PEPTIDES COMPRISING THIOESTER GROUPS, INCLUDING DEPSIPEPTIDE THIOESTERS, METHODS OF MAKING, AND USE THEREOF BRANDEIS UNIVERSITY (US) 2024-08-08 — — WO disclosed
US-20240051992-A1 THIOPHOSPHOPEPTIDES FOR ULTRAFAST TARGETING OF THE GOLGI APPARATUS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-02-15 — — US disclosed
WO-2022174058-A1 THIOPHOSPHOPEPTIDES FOR ULTRAFAST TARGETING OF THE GOLGI APPARATUS BRANDEIS UNIVERSITY (US) 2022-08-18 — — WO 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-20240051992-A1 THIOPHOSPHOPEPTIDES FOR ULTRAFAST TARGETING OF THE GOLGI APPARATUS PTMS, QPCT, TGOLN2 POLB 3015/4885KDM4E 4706/4885GLA 149/4885

“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.

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