SCHEMBL5077496

SCHEMBL5077496

COC(=O)C(F)Cc1cc(Br)c(O)c(Br)c1.COC(=O)COc1cc(Br)c(O)c(Br)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.41
TRPV1 Q8NER1 1/20 0.35
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
FOLH1 Q04609 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 2/20 0.34
HMGCR P04035 1/20 0.34
MAPT P10636 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTGS2 P35354 1/20 0.33
GLA P06280 1/20 0.33
ADRB2 P07550 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
SCHEMBL14540741 0.87 FOLH1 (0.41) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL3137725 0.87 FOLH1 (0.41) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL3146089 0.84 PDK2 (0.48) PDK2MEN1KMT2ALMNAHMGCR
SCHEMBL4927284 0.77 HPGD (0.43) MEN1KMT2ATHRATHRBLMNA
SCHEMBL14540985 0.74 TRPV1 (0.37) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL16904222 0.73 PDK2 (0.43) PDK2MEN1KMT2APOLBLMNA
SCHEMBL3911299 0.72 FOLH1 (0.41) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL2164006 0.72 FOLH1 (0.41) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL4817111 0.71 FOLH1 (0.40) TRPV1MEN1KMT2AFOLH1THRA
SCHEMBL18822126 0.71 THRB (0.47) TRPV1MEN1KMT2AFOLH1THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899309-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2008-03-19 EP disclosed
WO-2007003419-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2007-01-11 WO disclosed