SCHEMBL14096029

SCHEMBL14096029

O=C(COc1ccccc1)NC(=S)Nc1ccc(N2CC=CCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 15/20 0.67
▸ ALDH1A1 P00352 10/20 0.57
▸ MEN1 O00255 5/20 0.57
▸ KMT2A Q03164 5/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ HPGD P15428 3/20 0.55
▸ HTT P42858 2/20 0.55
▸ LMNA P02545 4/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.53
▸ GAA P10253 1/20 0.52
▸ THRB P10828 1/20 0.49
▸ POLB P06746 1/20 0.47

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
SCHEMBL4363886 0.86 NPC1 (0.78) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL14096025 0.85 MAPT (0.73) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL4365149 0.81 MAPT (0.65) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL14096020 0.80 ALDH1A1 (0.75) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4361501 0.78 MAPT (0.72) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL4364686 0.78 ALDH1A1 (0.72) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL14096016 0.77 MAPT (0.74) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL7822012 0.77 ALDH1A1 (0.76) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL14096475 0.77 MAPT (0.70) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL5450484 0.77 MAPT (0.74) MAPTALDH1A1MEN1KMT2ANPC1

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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 — — US disclosed
US-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 — — 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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv RNASE1, SARS1, EIF2AK2 MAPT 4038/4885ALDH1A1 2930/4885MEN1 4577/4885

“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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