SCHEMBL3707230

SCHEMBL3707230

CCOC(=O)CN(C(=O)c1ccccc1)c1cc(Br)c(Oc2ccc(OC)c(C(C)(C)C)c2)c(Br)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.36
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
MAPT P10636 4/20 0.35
RARA P10276 2/20 0.35
RARB P10826 2/20 0.35
RARG P13631 2/20 0.35
TSHR P16473 2/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
PPARG P37231 1/20 0.34

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
SCHEMBL3705439 0.88 TSPO (0.38) LMNAUSP2F2F10ITGB3
SCHEMBL3703153 0.86 THRB (0.45) THRATHRB
SCHEMBL3715784 0.85 TSHR (0.39) LMNAUSP2F2F10ITGB3
SCHEMBL3714771 0.85 ESR1 (0.38) LMNAUSP2F2F10ITGB3
SCHEMBL3711114 0.85 TSHR (0.44) LMNATSHRNPC1RAB9AALDH1A1
SCHEMBL3706682 0.84 THRB (0.39) LMNAUSP2F2F10ITGB3
SCHEMBL3710069 0.82 POLB (0.47) F2F10ITGB3ITGA2BMAPT
SCHEMBL3704908 0.82 MAPT (0.39) LMNAUSP2F2F10ITGB3
SCHEMBL3704670 0.82 TSHR (0.40) MAPTTSHRCYP1A2CYP2D6HPGD
SCHEMBL3704933 0.82 NR3C1 (0.38) LMNAUSP2F2F10ITGB3

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
WO-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO claimed
WO-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO disclosed