SCHEMBL4603689

SCHEMBL4603689

O=C(CNc1cccc(C(=O)O)c1)COc1ccccc1NC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
AKR1C3 P42330 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MITF O75030 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
PAX8 Q06710 1/20 0.51
KLF5 Q13887 1/20 0.51
MAPK1 P28482 1/20 0.50
DAPK1 P53355 1/20 0.50
PIM3 Q86V86 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NR1H4 Q96RI1 4/20 0.48
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.46

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
SCHEMBL4606890 0.90 RAB9A (0.61) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4604968 0.88 AKR1C3 (0.54) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4604349 0.86 AKR1C3 (0.52) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4606531 0.84 PPARA (0.52) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4605138 0.81 L3MBTL1 (0.54) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4603675 0.81 AKR1C3 (0.54) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL12427892 0.79 MAPK1 (0.58) SMN1; SMN2NPC1RAB9AMAPK1KMT2A
SCHEMBL4603654 0.76 AKR1C3 (0.48) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL4606307 0.76 AKR1C3 (0.48) SMN1; SMN2AKR1C3NPC1RAB9AMITF
SCHEMBL5160414 0.75 AKR1C3 (0.61) SMN1; SMN2AKR1C3NPC1RAB9AMITF

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
EP-1720825-B1 ANTHRANILIC ACID DERIVATIVES, METHODS FOR THEIR PREPARATION AND USE AS DHODH INHIBITORS ACTIVE BIOTECH AB (SE) 2008-07-09 EP disclosed
US-7074831-B2 Compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2006-07-11 US disclosed
US-20050187297-A1 New compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2005-08-25 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-20050187297-A1 New compounds, methods for their preparation and use thereof MALT1, TPMT, FUCA1 SMN1; SMN2 2803/4885AKR1C3 246/4885NPC1 2040/4885

“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.