SCHEMBL8960638

SCHEMBL8960638

[CH2]CCCC(C)(C)CCC=C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL8960648 0.85 TSHR (0.35) TSHRALDH1A1
SCHEMBL18478706 0.81 TSHR (0.52) TSHRALDH1A1
SCHEMBL4646811 0.79 TSHR (0.48) TSHRALDH1A1
SCHEMBL27556663 0.79 TSHR (0.52) TSHRALDH1A1
SCHEMBL5986388 0.76
SCHEMBL163785 0.75 TSHR (0.48) TSHRALDH1A1
SCHEMBL7700271 0.73 TSHR (0.33) TSHRALDH1A1
SCHEMBL8960642 0.73 TSHR (0.48) TSHRALDH1A1
SCHEMBL1973892 0.72
SCHEMBL21523578 0.72 TSHR (0.36) TSHRALDH1A1

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
EP-0693284-A1 PROSTACYCLIN-CONTAINING OLEAGINOUS OINTMENT TEIJIN LIMITED (JP) 1996-01-24 EP disclosed