SCHEMBL16005200

SCHEMBL16005200

NC1(O)CCCCC1(O)O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL6228112 0.93
SCHEMBL10338067 0.79 TSHR (0.35) TSHRCYP2C19
SCHEMBL9686906 0.79 TSHR (0.35) TSHRCYP2C19
SCHEMBL10442825 0.79 TSHR (0.35) TSHRCYP2C19
SCHEMBL30722274 0.79 TSHR (0.41) TSHRCYP2C19
SCHEMBL1681921 0.75
SCHEMBL1681773 0.73 ALDH1A1 (0.37)
SCHEMBL9438561 0.73 TSHR (0.32) TSHRCYP2C19
SCHEMBL10525010 0.71 TSHR (0.31) TSHRCYP2C19
SCHEMBL9245778 0.70 ALDH1A1 (0.42) TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP claimed
EP-2774915-A1 New derivatives of resveratrol Mattarei, Andrea (IT) 2014-09-10 EP disclosed