SCHEMBL9745814

SCHEMBL9745814

CCCCC[Sn](O)(CCCCC)CCCCC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
EPHX1 P07099 7/20 0.42
LMNA P02545 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FAAH O00519 1/20 0.39
CASP2 P42575 1/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36

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
SCHEMBL7994977 0.97 TSHR (0.50) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL10780923 0.97 TSHR (0.50) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL11327302 0.97 TSHR (0.50) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL932358 0.90 TSHR (0.40) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL9746087 0.88 TSHR (0.39) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL9745452 0.78
SCHEMBL9745220 0.78 TSHR (0.35) TSHRTHRBSMN1; SMN2EPHX1LMNA
SCHEMBL30815981 0.78 TSHR (0.50) TSHRTHRBSMN1; SMN2LMNAALDH1A1
SCHEMBL1405421 0.78 TSHR (0.50) TSHRTHRBSMN1; SMN2LMNAALDH1A1
SCHEMBL7899288 0.74

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
US-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed