SCHEMBL4221676

SCHEMBL4221676

COc1cccc(Nc2cc(-c3ccccc3)ccc2C(=O)O)c1

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 16/20 0.78
AKR1C2 P52895 16/20 0.78
PDE4B Q07343 1/20 0.58
TRPV1 Q8NER1 1/20 0.57
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
GFER P55789 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HCAR2 Q8TDS4 1/20 0.55

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
SCHEMBL30701240 0.88 AKR1C3 (1.00) AKR1C3AKR1C2MEN1LMNAHPGD
SCHEMBL9594214 0.88 AKR1C3 (1.00) AKR1C3AKR1C2MEN1LMNAHPGD
SCHEMBL4229310 0.87 AKR1C3 (0.74) AKR1C3AKR1C2
SCHEMBL4216592 0.86 AKR1C3 (0.65) AKR1C3AKR1C2
SCHEMBL4223666 0.86 SIRT2 (0.61) AKR1C3AKR1C2GFER
SCHEMBL11540106 0.85 AKR1C3 (0.79) AKR1C3AKR1C2MEN1LMNAHPGD
SCHEMBL9593696 0.84 AKR1C3 (0.82) AKR1C3AKR1C2MEN1LMNAHPGD
SCHEMBL4215780 0.84 IGF2BP2 (0.57) AKR1C3AKR1C2
SCHEMBL4223119 0.83 AKR1C3 (0.60) AKR1C3AKR1C2GFER
SCHEMBL28404353 0.83 AKR1C3 (0.81) AKR1C3AKR1C2MEN1LMNAHPGD

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-8327467-B2 Anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 US disclosed
EP-1860098-B1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-14 EP disclosed
US-20090105474-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-04-23 US disclosed
EP-1860098-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-28 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-20090105474-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF MMP13, MMP11, MMP3 AKR1C3 105/4885AKR1C2 287/4885PDE4B 4102/4885

“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.