SCHEMBL6715937

SCHEMBL6715937

COC(OC)c1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.53
HSD17B10 Q99714 1/20 0.50
RXRB P28702 6/20 0.49
RXRG P48443 2/20 0.49
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
BCL2L1 Q07817 1/20 0.48
BAD Q92934 1/20 0.48
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
ERN1 O75460 1/20 0.45
GRIA4 P48058 1/20 0.45
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44

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
SCHEMBL3876089 0.94 CA1 (0.54) RXRARXRBCA1CA2CA12
Bromide SCHEMBL10487161 0.92 CA1 (0.52) RXRARXRBCA1CA2CA12
SCHEMBL14714654 0.84 RARB (0.53) RXRARXRBCA1CA2CA12
SCHEMBL6716273 0.83 RXRA (0.69) RXRARXRBRXRG
SCHEMBL10519895 0.83 AKR1C2 (0.57) RXRAHSD17B10RXRBRXRGCA1
SCHEMBL6716372 0.83 CA1 (0.55) CA1CA2CA12CA9CA14
SCHEMBL15350067 0.81 TSHR (0.34) HSD17B10CA1CA2CA12CA9
SCHEMBL21162070 0.81 TSHR (0.34) HSD17B10CA1CA2CA12CA9
SCHEMBL2627825 0.78 RXRA (0.68) RXRAHSD17B10RXRBRXRGCA1
SCHEMBL6924039 0.78 MAPT (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130072677-A1 NOVEL HYDROXAMIC ACID DERIVATIVE TOYAMA CHEMICAL CO., LTD. (JP) 2013-03-21 US disclosed
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 (2 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 RXRA 486/4885HSD17B10 141/4885RXRB 578/4885
US-20130072677-A1 NOVEL HYDROXAMIC ACID DERIVATIVE LCT, AGXT, HDAC9 RXRA 3071/4885HSD17B10 164/4885RXRB 3064/4885

“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.