SCHEMBL5793286

SCHEMBL5793286

CCC(C)CO[C@@H](C)CCO

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 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
SCHEMBL5793288 1.00 TDP1 (0.32) TDP1TSHRMAPTALDH1A1ALOX15
SCHEMBL9134726 0.81 TSHR (0.35) TDP1TSHRMAPT
SCHEMBL9134724 0.81 TSHR (0.35) TDP1TSHRMAPT
SCHEMBL13559910 0.81 TSHR (0.35) TDP1TSHR
SCHEMBL5820799 0.80 TSHR (0.31) TSHRMAPT
SCHEMBL19680485 0.80 TDP1 (0.35) TDP1TSHR
SCHEMBL5820794 0.80 TSHR (0.31) TSHRMAPT
SCHEMBL712244 0.78 TSHR (0.33) TDP1TSHR
SCHEMBL19883178 0.78 TDP1 (0.33) TDP1MAPT
SCHEMBL9427679 0.77

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-2006025687-A1 CHIRAL ALKOXY ALCOHOLS, CHIRAL 1 ,3-PHENYLENE-BΙS[4-(4-ALKOXY) PHENYLIMINOMETHYL] BENZOATES AND PROCESSES FOR PREPARATION THEREOF DONGJIN SEMICHEM CO., LTD. (KR) 2006-03-09 WO disclosed