SCHEMBL6763989

SCHEMBL6763989

CC(C)C(=O)C(=Cc1ccc(F)cc1)C(=O)Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
RAB9A P51151 5/20 0.55
NPC1 O15118 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
POLB P06746 4/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA7 P43166 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
SCHEMBL6763984 1.00 MAPT (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL5820791 0.94 RAB9A (0.62) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL5809204 0.93 MAPT (0.51) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL6695821 0.91 MAPT (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL927020 0.91 MAPT (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL10045756 0.91 MAPT (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL6769183 0.89 ALDH1A1 (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL6769185 0.89 ALDH1A1 (0.55) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL5808255 0.88 MAOA (0.46) MAPTRAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL5808254 0.88 MAOA (0.46) MAPTRAB9ANPC1SMN1; SMN2NFKB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040102511-A1 Substituted pyrrole derivatives RANBAXY LABORATORIES LIMITED (IN) 2004-05-27 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-20040102511-A1 Substituted pyrrole derivatives HMGCR, PC, CYP46A1 MAPT 1678/4885RAB9A 1875/4885NPC1 44/4885

“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.