SCHEMBL20115375

SCHEMBL20115375

CCC(C)(CC(C)(C)C)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL23888841 0.82 TSHR (0.39) TSHRTDP1
SCHEMBL17576274 0.81
SCHEMBL20115579 0.80 TSHR (0.30) TSHRTDP1
SCHEMBL18607207 0.78 TSHR (0.35) TSHRTDP1
SCHEMBL19835495 0.76
SCHEMBL25722060 0.76 TSHR (0.33) TSHRTDP1
SCHEMBL20261079 0.74 CYP2D6 (0.41)
SCHEMBL23471809 0.72
SCHEMBL22558622 0.71 TSHR (0.32) TSHRTDP1
SCHEMBL365870 0.71

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-2889298-B1 4-POSITION SUBSTITUTED PYRAZOLOPYRIMIDINE DERIVATIVE, AND USE THEREOF IN DRUG PREPARATION GUANGXI WUZHOU PHARMACEUTICALS GROUP CO LTD (CN) 2018-05-02 EP disclosed