SCHEMBL7675971

SCHEMBL7675971

CCOC(=O)c1csc(-c2ccc(O)c3ccccc23)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
ALDH1A1 P00352 2/20 0.56
RAB9A P51151 9/20 0.55
NPC1 O15118 7/20 0.55
POLB P06746 1/20 0.55
PKM P14618 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
GAA P10253 2/20 0.52
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 1/20 0.49
FGB P02675 1/20 0.48
CLK1 P49759 1/20 0.47
CYP19A1 P11511 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAOA P21397 1/20 0.45

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
SCHEMBL7380938 0.88 RAB9A (0.56) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL6983909 0.86 RAB9A (0.56) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL2551417 0.85 HTR2B (0.61) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL7473845 0.84 MAPT (0.53) MAPTALDH1A1RAB9ANPC1POLB
Dimethylamine SCHEMBL7678579 0.82 RAB9A (0.50) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL7384817 0.82 RAB9A (0.50) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL15754817 0.81 RAB9A (0.60) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL13548675 0.81 RAB9A (0.56) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL13144514 0.80 MAPT (0.70) MAPTALDH1A1RAB9ANPC1POLB
SCHEMBL6224829 0.80 RAB9A (0.61) MAPTALDH1A1RAB9ANPC1POLB

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-20020049316-A1 Protease inhibitors HALBERT STACIE MARIE (US) 2002-04-25 US disclosed
CN-1261276-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2000-07-26 CN 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-20020049316-A1 Protease inhibitors CTSK, CTSZ, CTSG MAPT 796/4885ALDH1A1 2831/4885RAB9A 827/4885

“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.