SCHEMBL7468178

SCHEMBL7468178

COc1ccccc1CN1C(=O)C(CCOc2ccc(CCNC(=N)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc2)Oc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.42
TP53 P04637 2/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL8603773 0.86 PPARG (0.44) PPARGTP53LMNA
SCHEMBL8604513 0.80 TSHR (0.44) PPARGTP53LMNA
SCHEMBL7468173 0.80 PPARG (0.41) PPARG
SCHEMBL8603793 0.78 ALDH1A1 (0.45) PPARGTP53LMNA
SCHEMBL8554097 0.78 ALDH1A1 (0.45) PPARGTP53
SCHEMBL8557139 0.78 TP53 (0.42) PPARGTP53
SCHEMBL8557727 0.77 GSK3B (0.47) PPARGTP53LMNA
SCHEMBL7476790 0.75 TSHR (0.45) PPARGTP53
SCHEMBL8551614 0.75 TSHR (0.43) PPARGTP53
SCHEMBL8604584 0.75 KDM4E (0.45) PPARGTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869949-B1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO MCNEIL PHARM INC (US) 2002-12-18 EP disclosed