SCHEMBL9738502

SCHEMBL9738502

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

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
PTPN1 P18031 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
SCHEMBL17953985 0.78 PTPN1 (0.35) TSHRPTPN1
SCHEMBL21408150 0.78 TSHR (0.32) TSHR
SCHEMBL1782275 0.78 PTPN1 (0.35) TSHRPTPN1
SCHEMBL28133810 0.77 TSHR (0.35) TSHR
SCHEMBL2219104 0.76 TSHR (0.30) TSHR
SCHEMBL3336438 0.74 ACE2 (0.35) TSHR
SCHEMBL11561306 0.74 CA1 (0.34) TSHR
SCHEMBL9764128 0.74 TSHR (0.33) TSHR
SCHEMBL23544567 0.74
SCHEMBL2825581 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-5126374-A For plants, seeds, soils, effective at low concentrations BASF AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed