SCHEMBL22600528

SCHEMBL22600528

CCC(C)(CC)C(C)N(C)CCCC=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
HIF1A Q16665 1/20 0.31
FAAH O00519 2/20 0.31
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL2562009 0.71
SCHEMBL14459669 0.68 PIK3CD (0.41)
SCHEMBL21780179 0.68 TSHR (0.31) TSHRHIF1A
SCHEMBL22788873 0.67 TSHR (0.44) TSHRHIF1AFAAHTRPV1
SCHEMBL24343505 0.66 TSHR (0.33) TSHR
SCHEMBL21942117 0.66 TSHR (0.41) TSHRHIF1AFAAHTRPV1
SCHEMBL10287787 0.65 ALDH1A1 (0.36) TSHR
SCHEMBL20084448 0.64 TSHR (0.32) TSHR
SCHEMBL1751213 0.64
SCHEMBL7672956 0.63 HIF1A (0.43) TSHRHIF1AFAAHTRPV1

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
WO-2020218317-A1 PARTICLE, AFFINITY PARTICLE, TEST REAGENT, AND DETECTION METHOD キヤノン株式会社 2020-10-29 WO disclosed