SCHEMBL27765491

SCHEMBL27765491

C=C(C)C(=O)OP(=O)(O)OCCCC(CC)[N+](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
BTN3A1 O00481 1/20 0.31

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
SCHEMBL27765382 0.86 TSHR (0.33) TSHR
SCHEMBL27765173 0.85 TSHR (0.35) TSHR
SCHEMBL27881679 0.78 TSHR (0.47) TSHRBTN3A1
SCHEMBL27991506 0.77 ADRA1D (0.31)
SCHEMBL28325465 0.77 TSHR (0.54) TSHRBTN3A1
SCHEMBL25430754 0.76 TSHR (0.57) TSHR
SCHEMBL27813919 0.76 TSHR (0.57) TSHR
SCHEMBL27785449 0.76 TSHR (0.57) TSHR
SCHEMBL14992893 0.76 TSHR (0.57) TSHR
SCHEMBL27834064 0.76 TSHR (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101466554-A Offset printing plate, offset printing plate material, support for offset printing plate and offset printing method KONICA MINOLTA MEDICAL PRINTIN (JP) 2009-06-24 CN disclosed