SCHEMBL6036205

SCHEMBL6036205

COc1cc(CC(=O)O)cc(OCCCc2cn(-c3ccc(C(F)(F)F)cn3)nc2C(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.38
RXRB P28702 2/20 0.38
RXRG P48443 2/20 0.38
EGLN1 Q9GZT9 1/20 0.37
GCGR P47871 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
AKR1C3 P42330 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
GCG P01275 1/20 0.33
PPARD Q03181 2/20 0.33
PPARG P37231 2/20 0.33
HDAC4 P56524 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL6036306 0.89 NR1H3 (0.39) RXRAEGLN1SMN1; SMN2KDM4EMEN1
SCHEMBL6034637 0.87 GCGR (0.38) RXRARXRBRXRGEGLN1GCGR
SCHEMBL6036338 0.87 AKR1C3 (0.40) GCGRSMN1; SMN2AKR1C3KDM4ELMNA
SCHEMBL6034299 0.87 RXRA (0.38) RXRARXRBRXRGEGLN1GCGR
SCHEMBL6035465 0.87 PLA2G4B (0.39) RXRAEGLN1SMN1; SMN2KDM4EMEN1
SCHEMBL6035224 0.87 SMN1; SMN2 (0.39) RXRARXRBRXRGGCGRSMN1; SMN2
SCHEMBL6035532 0.86 HSD17B10 (0.40) SMN1; SMN2AKR1C3KDM4ELMNAMAPK1
SCHEMBL6034532 0.86 PPARD (0.43) SMN1; SMN2KMT2APPARDPTGDR2PPARA
SCHEMBL6035776 0.86 PPARD (0.39) KMT2APPARDPTGDR2PPARA
SCHEMBL6035517 0.84 FFAR4 (0.38) EGLN1GCGRSMN1; SMN2KDM4EPPARD

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
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 RXRA 183/4885RXRB 188/4885RXRG 275/4885

“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.