SCHEMBL7052396

SCHEMBL7052396

CC(C)(C)c1ccc(COc2cccc(C(=O)O)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 9/20 1.00
NR4A1 P22736 1/20 1.00
NR4A3 Q92570 1/20 1.00
RXRA P19793 2/20 0.70
RXRB P28702 2/20 0.70
MAOB P27338 3/20 0.62
MRGPRX4 Q96LA9 3/20 0.60
SRD5A2 P31213 1/20 0.59
NR1H4 Q96RI1 1/20 0.58
RXRG P48443 1/20 0.57
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL4639706 0.88 NR4A2 (0.78) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL7049784 0.86 NR4A2 (0.78) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL8458870 0.86 NR4A2 (0.76) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL7221881 0.84 MAOB (0.78) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL27815839 0.84 NR4A2 (0.82) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL30994900 0.84 NR4A2 (0.82) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL30207018 0.84 NR4A2 (1.00) NR4A2NR4A1NR4A3MAOBMRGPRX4
SCHEMBL339009 0.84 NR4A2 (1.00) NR4A2NR4A1NR4A3MAOBMRGPRX4
SCHEMBL1186257 0.83 SMN1; SMN2 (0.76) NR4A2NR4A1NR4A3RXRARXRB
SCHEMBL9813418 0.82 RXRA (1.00) NR4A2NR4A1NR4A3RXRARXRB

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-20030191323-A1 Hypoglycemic agent AJINOMOTO CO., INC. (JP) 2003-10-09 US disclosed
US-20030162818-A1 Acylsulfonamide derivative AJINOMOTO CO. INC. (JP) 2003-08-28 US disclosed
US-6555584-B1 Acetyl-coa carboxylase inhibitors AJINOMOTO CO., INC. (JP) 2003-04-29 US disclosed
EP-1300142-A1 HYPOGLYCEMICS Ajinomoto Co., Inc. (JP) 2003-04-09 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-20030162818-A1 Acylsulfonamide derivative ACSS2, ACACA, FASN NR4A2 2332/4885NR4A1 1480/4885NR4A3 2214/4885
US-20030191323-A1 Hypoglycemic agent GPR119, IAPP, SLC5A2 NR4A2 3157/4885NR4A1 3224/4885NR4A3 3215/4885

“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.