SCHEMBL6714858

SCHEMBL6714858

COCOc1c(C)cc(-c2ccc(C(=O)OC)cc2)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.51
TDP1 Q9NUW8 2/20 0.46
MAPT P10636 3/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA9 Q16790 4/20 0.44
CA14 Q9ULX7 4/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
ERN1 O75460 3/20 0.43
SLC2A1 P11166 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CA7 P43166 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.41

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
SCHEMBL6716590 0.87 EGFR (0.56) EGFRERN1
SCHEMBL3674748 0.82 PTPN1 (0.52) EGFRTDP1MAPTLMNAGAA
SCHEMBL3674745 0.82 PTPN1 (0.52) EGFRTDP1MAPTLMNAGAA
SCHEMBL3821169 0.78 ERN1 (0.56) EGFRTDP1MAPTLMNAGAA
SCHEMBL16749645 0.77 CA1 (0.61) EGFRTDP1MAPTCA12CA1
SCHEMBL10009170 0.77 CA1 (0.61) EGFRTDP1MAPTCA12CA1
SCHEMBL19608964 0.76 TDP1 (0.53) EGFRTDP1MAPTCA12CA1
SCHEMBL11560594 0.76 PPARG (0.44) EGFRMAPTGAAKDM4EALDH1A1
SCHEMBL13830583 0.76 TDP1 (0.57) EGFRTDP1MAPTLMNAGAA
SCHEMBL17756693 0.75 TDP1 (0.52) TDP1MAPTLMNAGAACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 EGFR 629/4885TDP1 4224/4885MAPT 4838/4885

“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.