SCHEMBL7046906

SCHEMBL7046906

O=C(NCC(C(=O)NCC(O)(CCc1ccccc1)c1nc2ccccc2o1)S(=O)(=O)Cc1ccccc1)C1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 2/20 0.36
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MTNR1A P48039 2/20 0.34
MTNR1B P49286 2/20 0.34
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL6462741 0.87 FAAH (0.36) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL6462894 0.86 MEN1 (0.38) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7043453 0.86 LMNA (0.43) MAPTLMNAALDH1A1POLBMEN1
SCHEMBL7049542 0.82 MAPT (0.40) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL6063046 0.79 LMNA (0.36) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL6467035 0.76 LMNA (0.47) MAPTLMNAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL6465937 0.75 FAAH (0.35) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL6466282 0.74 LMNA (0.39) MAPTLMNAMEN1KMT2ATSHR
SCHEMBL7042868 0.74 MAPT (0.36) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7045974 0.74 CTSS (0.43) MAPTLMNAALDH1A1MEN1KMT2A

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-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ MAPT 2414/4885LMNA 1755/4885ALDH1A1 3027/4885

“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.