SCHEMBL6285283

SCHEMBL6285283

NC(=O)CC[C@@](N)(C(=O)Cc1ccsc1)C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@@](N)(CCC(N)=O)C(=O)Cc3ccsc3)cc2)c2ccc(NC(=O)[C@@](N)(CCC(N)=O)C(=O)Cc3ccsc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.36
KMT2A Q03164 1/20 0.35
SIRT5 Q9NXA8 1/20 0.35
POLB P06746 2/20 0.33
ESR2 Q92731 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.32
MAPT P10636 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
GLS O94925 1/20 0.31

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
SCHEMBL7037676 0.89 RAB9A (0.42) RAB9ANPC1TDP1L3MBTL1KMT2A
SCHEMBL6291029 0.86 RAB9A (0.43) RAB9ANPC1TDP1L3MBTL1KMT2A
SCHEMBL6285275 0.85 RAB9A (0.38) RAB9ANPC1TDP1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6287062 0.85 RAB9A (0.39) RAB9ANPC1TDP1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6285424 0.85 RAB9A (0.39) RAB9ANPC1TDP1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6287055 0.83 RAB9A (0.36) RAB9ANPC1TDP1L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6287756 0.83 RAB9A (0.36) RAB9ANPC1TDP1L3MBTL1KMT2A
SCHEMBL6290991 0.82 RAB9A (0.41) RAB9ANPC1TDP1L3MBTL1KMT2A
SCHEMBL6290320 0.78 CA1 (0.39) RAB9ANPC1TDP1L3MBTL1SIRT5
SCHEMBL6287076 0.78 CA1 (0.39) RAB9ANPC1TDP1L3MBTL1SIRT5

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
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 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 (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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK RAB9A 4327/4885NPC1 3910/4885TDP1 4329/4885

“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.