SCHEMBL7085334

SCHEMBL7085334

CC(C)Cc1c[nH]c2ccc(Oc3c(C(F)(F)F)c[c]cc3C(F)(F)F)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 7/20 0.49
THRB P10828 7/20 0.49
HTR2C P28335 3/20 0.46
HTR2B P41595 3/20 0.46
HTR1A P08908 3/20 0.46
HTR2A P28223 2/20 0.46
HTR1B P28222 3/20 0.41
GPR84 Q9NQS5 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
KMT2A Q03164 2/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
MTOR P42345 1/20 0.39
HTR6 P50406 1/20 0.39
SLC6A3 Q01959 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL7088760 0.87 THRA (0.52) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL7087898 0.83 HTR2C (0.49) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL6985830 0.83 HTR2A (0.49) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL7084815 0.82 THRA (0.50) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL6510913 0.81 THRA (0.75) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL7088995 0.81 THRA (0.56) THRATHRBHTR2CHTR2BHTR2A
SCHEMBL7088864 0.81 THRA (0.47) THRATHRBHTR1AHTR1BGPR84
SCHEMBL6512432 0.81 THRA (0.60) THRATHRBHTR2CHTR2BHTR1A
SCHEMBL7087920 0.81 HTR1A (0.44) THRATHRBHTR1AHTR1BSLC6A4
SCHEMBL6981325 0.80 THRA (0.48) THRATHRBHTR2CHTR2BHTR1A

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-1268422-A1 INDOLES FOR TREATING DISEASES THAT CAN BE TREATED USING THYROID HORMONES Bayer Aktiengesellschaft (DE) 2003-01-02 EP disclosed
WO-2001070687-A1 INDOLES FOR TREATING DISEASES THAT CAN BE TREATED USING THYROID HORMONES BAYER AKTIENGESELLSCHAFT (DE) 2001-09-27 WO disclosed