SCHEMBL4225580

SCHEMBL4225580

COc1ccc(Nc2cc(-c3ccccc3)ccc2C(=O)O)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 15/20 0.60
AKR1C2 P52895 15/20 0.60
GAA P10253 1/20 0.55
KDM4E B2RXH2 1/20 0.54
APAF1 O14727 1/20 0.54
RECQL P46063 1/20 0.54
CASP6 P55212 1/20 0.54
CACNA1B Q00975 1/20 0.54
APBA1 Q02410 1/20 0.54
MCL1 Q07820 1/20 0.54
CASP8 Q14790 1/20 0.54
FABP3 P05413 1/20 0.52
FABP4 P15090 1/20 0.52
ACLY P53396 1/20 0.49
PRSS12 P56730 1/20 0.48

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
SCHEMBL31494629 0.85 AKR1C3 (0.67) AKR1C3AKR1C2GAAKDM4EAPAF1
SCHEMBL10834828 0.85 AKR1C3 (0.67) AKR1C3AKR1C2GAAKDM4EAPAF1
SCHEMBL4225648 0.85 AKR1C3 (0.64) AKR1C3AKR1C2GAA
SCHEMBL4229310 0.83 AKR1C3 (0.74) AKR1C3AKR1C2PRSS12
SCHEMBL4223433 0.83 FABP4 (0.58) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL4215380 0.82 AKR1C3 (0.56) AKR1C3AKR1C2GAA
SCHEMBL4221676 0.81 AKR1C3 (0.78) AKR1C3AKR1C2
SCHEMBL30294718 0.80 AKR1C3 (0.63) AKR1C3AKR1C2
SCHEMBL22853342 0.80 AKR1C3 (0.63) AKR1C3AKR1C2
SCHEMBL10074768 0.79 AKR1C3 (0.73) AKR1C3AKR1C2KDM4EAPAF1RECQL

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 287/4885GAA 3059/4885

“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.