SCHEMBL6334159

SCHEMBL6334159

CCCCO[Ti](O)(O)OC(OC)OC

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 1/20 0.30

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
SCHEMBL6332357 0.92 LPAR3 (0.36)
SCHEMBL6330177 0.88
SCHEMBL2133039 0.79 LMNA (0.35) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL2789915 0.78 TSHR (0.42) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL414710 0.69 THRB (0.44) TSHRALDH1A1
SCHEMBL10477083 0.69 THRB (0.44) TSHRALDH1A1
SCHEMBL1629409 0.68 TSHR (0.42) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL1886639 0.68
SCHEMBL20513188 0.67 ATM (0.34) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL20513648 0.67 TSHR (0.30) TSHR

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
US-6852460-B2 Toner and image forming method using the same KYOCERA CORPORATION (JP) 2005-02-08 US disclosed
US-20030186151-A1 Toner and image forming method using the same KYOCERA CORPORATION 2003-10-02 US disclosed