SCHEMBL13779379

SCHEMBL13779379

O=C(Nc1cc2ccccc2oc1=O)c1cccs1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.68
▸ MAOB P27338 11/20 0.65
▸ SMN1; SMN2 Q16637 5/20 0.65
▸ RAB9A P51151 5/20 0.65
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ PKM P14618 2/20 0.65
▸ ALDH1A1 P00352 6/20 0.61
▸ MAPT P10636 4/20 0.61
▸ KDM4E B2RXH2 4/20 0.60
▸ HPGD P15428 2/20 0.60
▸ CYP1A2 P05177 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ MAOA P21397 1/20 0.60
▸ HSD17B10 Q99714 1/20 0.60
▸ ACHE P22303 5/20 0.60
▸ CACNA1B Q00975 1/20 0.56
▸ APBA1 Q02410 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ POLB P06746 1/20 0.56

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
SCHEMBL4823094 0.86 TP53 (0.66) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL17716806 0.80 ALDH1A1 (0.49) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL16383876 0.79 ALDH1A1 (0.68) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL17318526 0.77 POLB (0.63) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL28563825 0.77 SMN1; SMN2 (0.74) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL3923306 0.77 KMT2A (0.51) NPC1SMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL1436180 0.77 MAPT (0.68) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL17712427 0.76 KMT2A (0.71) NPC1SMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL893303 0.76 KDM4E (1.00) NPC1MAOBSMN1; SMN2RAB9AMEN1
SCHEMBL5672455 0.75 NPC1 (0.67) NPC1MAOBSMN1; SMN2RAB9AMEN1

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
US-20090176773-A1 Non-Peptidic Inhibitors of AKAP/PKA Interaction FORSCHUNGSVERBUND BERLIN E.V. (DE) 2009-07-09 — — US disclosed
US-20090176773-A1 Non-Peptidic Inhibitors of AKAP/PKA Interaction FORSCHUNGSVERBUND BERLIN E.V. (DE) 2009-07-09 — — 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-20090176773-A1 Non-Peptidic Inhibitors of AKAP/PKA Interaction PRKCH, AIP, PRKCE NPC1 1716/4885MAOB 3179/4885SMN1; SMN2 4491/4885

“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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