SCHEMBL7047004

SCHEMBL7047004

CCCCC(O)(CNC(=O)CC(NC(C)=O)C1CCCCC1)c1nc2ccccc2o1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HIF1A Q16665 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 2/20 0.34
FASN P49327 3/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
HTT P42858 1/20 0.33
ALOX5 P09917 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
FAAH O00519 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL7044868 0.90 LMNA (0.37) MAPTKMT2ATSHRFASNLMNA
SCHEMBL7182965 0.88 KMT2A (0.36) MAPTKMT2ATSHRFASNLMNA
SCHEMBL6464160 0.76 LMNA (0.39) MAPTKMT2ATSHRLMNASMN1; SMN2
SCHEMBL7048374 0.76 POLB (0.38)
SCHEMBL7045897 0.75 EPHX2 (0.38) KMT2ATSHRSMN1; SMN2NPC1RAB9A
SCHEMBL7049550 0.74 DAGLA (0.46) MAPTALDH1A1TSHRLMNASMN1; SMN2
SCHEMBL6463625 0.73 KCNJ6 (0.36) KMT2ASMN1; SMN2NPC1RAB9AFAAH
SCHEMBL6061692 0.72 CTSS (0.41) KMT2ALMNASMN1; SMN2HTTFAAH
SCHEMBL6062880 0.71 FAAH (0.41) MAPTALDH1A1KMT2ATSHRFASN
SCHEMBL7045443 0.70 MEN1 (0.45) MAPTALDH1A1KMT2ATSHRLMNA

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 2414/4885ALDH1A1 3027/4885HIF1A 3205/4885

“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.