SCHEMBL29635328

SCHEMBL29635328

O=C(OCc1ccc(SSc2ccc([N+](=O)[O-])cn2)cc1)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.56
MAOB P27338 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 3/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PLA2G4B P0C869 1/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
GAA P10253 2/20 0.39

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
SCHEMBL22883054 1.00 HTR2A (0.56) HTR2AMAOBL3MBTL1RAB9AMAPT
SCHEMBL12575467 0.88 HTR2A (0.54) HTR2AMAOBL3MBTL1RAB9AMAPT
SCHEMBL5827968 0.81 HTR2A (0.80) HTR2AMAOBL3MBTL1RAB9APLA2G4B
SCHEMBL16937928 0.80 HTR2A (0.53) HTR2AMAOBL3MBTL1RAB9AMAPT
SCHEMBL17583222 0.79 HTR2A (0.43) HTR2AMAPTKMT2AHDAC1HDAC2
SCHEMBL28888688 0.79 MAPT (0.56) RAB9AMAPTNPSR1NPC1KMT2A
SCHEMBL29523967 0.79 MAPT (0.56) RAB9AMAPTNPSR1NPC1KMT2A
SCHEMBL22883115 0.78 MAPT (0.48) RAB9AMAPTNPSR1NPC1KMT2A
SCHEMBL14621621 0.78 HTR2A (0.74) HTR2AMAOBL3MBTL1RAB9APLA2G4B
SCHEMBL18758083 0.77 HTR2A (0.48) HTR2ARAB9AMAPTNPC1KMT2A

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-12234212-B2 Peptide conjugates of microtubule-targeting agents as therapeutics Cybrexa 3, Inc. (US) 2025-02-25 US disclosed
US-20240067616-A1 PEPTIDE CONJUGATES OF MICROTUBULE-TARGETING AGENTS AS THERAPEUTICS Cybrexa 3, Inc. 2024-02-29 US disclosed
US-11555019-B2 Peptide conjugates of microtubule-targeting agents as therapeutics Cybrexa 3, Inc. (US) 2023-01-17 US disclosed
EP-3996749-A1 PEPTIDE CONJUGATES OF MICROTUBULE-TARGETING AGENTS AS THERAPEUTICS Cybrexa 3, Inc. (US) 2022-05-18 EP 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 (3 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-20240067616-A1 PEPTIDE CONJUGATES OF MICROTUBULE-TARGETING AGENTS AS THERAPEUTICS MAP4, MAP2, TUBB3 HTR2A 4426/4885MAOB 4341/4885L3MBTL1 1636/4885
US-12234212-B2 Peptide conjugates of microtubule-targeting agents as therapeutics MAP4, MAP2, TUBB3 HTR2A 4426/4885MAOB 4341/4885L3MBTL1 1636/4885
US-11555019-B2 Peptide conjugates of microtubule-targeting agents as therapeutics MAP4, MAP2, TUBB3 HTR2A 4426/4885MAOB 4341/4885L3MBTL1 1636/4885

“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.