SCHEMBL6294665

SCHEMBL6294665

COc1cccc(-c2ccccc2C(=O)Nc2ccc(F)cc2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.73
KDM4E B2RXH2 2/20 0.73
POLB P06746 1/20 0.67
MAPT P10636 4/20 0.64
TP53 P04637 2/20 0.64
NPC1 O15118 3/20 0.62
RAB9A P51151 2/20 0.62
ALDH1A1 P00352 4/20 0.61
TSHR P16473 4/20 0.61
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
HPGD P15428 1/20 0.61
HTT P42858 2/20 0.56
HSD17B10 Q99714 1/20 0.56
PLAU P00749 1/20 0.53
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
USP2 O75604 1/20 0.53
CHRNB2 P17787 1/20 0.52
CHRNB4 P30926 1/20 0.52

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
SCHEMBL6300807 0.91 GAA (0.80) GAAKDM4EPOLBMAPTNPC1
SCHEMBL6294912 0.88 GAA (0.74) GAAKDM4EPOLBMAPTTP53
SCHEMBL6295717 0.88 GAA (0.70) GAAKDM4EPOLBMAPTNPC1
SCHEMBL6300626 0.84 HTT (0.72) GAAKDM4EPOLBMAPTTP53
SCHEMBL29970845 0.81 CHRNB2 (0.78) GAAKDM4EPOLBMAPTTP53
SCHEMBL29201497 0.81 CHRNB2 (0.78) GAAKDM4EPOLBMAPTTP53
SCHEMBL6294961 0.81 HTT (0.60) GAAKDM4EPOLBMAPTTP53
SCHEMBL6295710 0.81 GAA (0.74) GAAKDM4EPOLBMAPTNPC1
SCHEMBL977594 0.80 GAA (0.65) GAAKDM4EPOLBNPC1RAB9A
SCHEMBL6794256 0.79 NPC1 (0.55) GAAKDM4EPOLBMAPTTP53

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-6897316-B2 Substituted 2-phenyl-4-quinolone-3-carboxylic acid compounds and their use as antitumor agents CHINA MEDICAL UNIVERSITY (TW) 2005-05-24 US disclosed
US-20050032832-A1 Substituted 2-phenyl-4-quinolone-3-carboxylic acid compounds and their use as antitumor agents CHINA MEDICAL UNIVERSITY (TW) 2005-02-10 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-20050032832-A1 Substituted 2-phenyl-4-quinolone-3-carboxylic acid compounds and their use as antitumor agents TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CHUK GAA 211/4885KDM4E 1042/4885POLB 1876/4885

“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.