SCHEMBL4655825

SCHEMBL4655825

CC[C](CC(CC)CC)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33

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
SCHEMBL10734089 0.77 ALDH1A1 (0.36) TSHR
SCHEMBL506039 0.75
SCHEMBL6389618 0.71 TSHR (0.31) TSHR
SCHEMBL4652993 0.70 ALDH1A1 (0.54) TSHR
SCHEMBL9058713 0.67 TSHR (0.33) TSHR
SCHEMBL19114388 0.67 TSHR (0.33) TSHR
SCHEMBL4621590 0.65
SCHEMBL4654364 0.65 TSHR (0.37) TSHR
SCHEMBL834918 0.63
SCHEMBL3632450 0.63

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1440155-B1 LIPASE VARIANTS BASF SE (DE) 2008-11-12 EP disclosed
EP-1440155-A2 LIPASE VARIANTS BASF AKTIENGESELLSCHAFT (DE) 2004-07-28 EP disclosed
WO-2003035878-A2 LIPASE VARIANTS BASF AKTIENGESELLSCHAFT (DE) 2003-05-01 WO disclosed
EP-1069183-A2 Immobilized lipase BASF AKTIENGESELLSCHAFT (DE) 2001-01-17 EP disclosed