SCHEMBL10144077

SCHEMBL10144077

COc1ccc(/C(N)=N/OC(=O)Cc2cccs2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 10/20 1.00
▸ NPC1 O15118 6/20 1.00
▸ RAB9A P51151 5/20 1.00
▸ SMN1; SMN2 Q16637 4/20 1.00
▸ CASP3 P42574 1/20 1.00
▸ SENP8 Q96LD8 1/20 1.00
▸ SENP7 Q9BQF6 1/20 1.00
▸ SENP6 Q9GZR1 1/20 1.00
▸ CYP1A2 P05177 1/20 0.77
▸ CYP3A4 P08684 1/20 0.77
▸ CYP2C9 P11712 1/20 0.77
▸ CYP2C19 P33261 1/20 0.77
▸ MAPT P10636 5/20 0.74
▸ ALDH1A1 P00352 4/20 0.74
▸ POLB P06746 3/20 0.74
▸ LMNA P02545 2/20 0.74
▸ KMT2A Q03164 4/20 0.74
▸ MEN1 O00255 2/20 0.74
▸ GAA P10253 3/20 0.67
▸ TDP1 Q9NUW8 2/20 0.65

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
SCHEMBL13171361 0.85 NPC1 (0.78) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL7037329 0.78 KMT2A (0.67) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL23094253 0.78 L3MBTL1 (1.00) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL18133382 0.76 MAPT (0.71) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL4589468 0.72 NPC1 (0.61) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL28670281 0.72 NPC1 (0.59) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL236205 0.71 HPGD (0.56) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL14669481 0.71 L3MBTL1 (0.73) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
Hydrochloric Acid SCHEMBL27610313 0.70 HPGD (0.54) L3MBTL1NPC1RAB9ASMN1; SMN2CASP3
SCHEMBL5350551 0.69 RAB9A (0.76) NPC1RAB9ASMN1; SMN2CYP2C9ALDH1A1

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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 — — 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 L3MBTL1 1767/4885NPC1 764/4885RAB9A 3256/4885

“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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