SCHEMBL8846986

SCHEMBL8846986

Brc1c(OCC2CO2)ccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
GLA P06280 1/20 0.51
TSHR P16473 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RAB9A P51151 3/20 0.48
TDP1 Q9NUW8 1/20 0.47
RXFP1 Q9HBX9 4/20 0.47
TP53 P04637 2/20 0.45
MAPK1 P28482 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HPGD P15428 1/20 0.45
PRNP P04156 5/20 0.44
LMNA P02545 1/20 0.43
CYP3A4 P08684 2/20 0.42
HIF1A Q16665 1/20 0.42
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL30026680 0.84 TDP1 (0.54) ALDH1A1GLATSHRTDP1TP53
SCHEMBL10010232 0.84 TDP1 (0.54) ALDH1A1GLATSHRTDP1TP53
SCHEMBL382088 0.83 ALDH1A1 (0.53) ALDH1A1GLATSHRTDP1TP53
SCHEMBL29535540 0.83 ALDH1A1 (0.53) ALDH1A1GLATSHRTDP1TP53
SCHEMBL8847205 0.82 RXFP1 (0.50) ALDH1A1GLATSHRL3MBTL1TDP1
SCHEMBL24591597 0.82 ALDH1A1 (0.51) ALDH1A1GLATSHRTDP1TP53
SCHEMBL18237415 0.82 ALDH1A1 (0.51) ALDH1A1GLATSHRTDP1TP53
SCHEMBL30620981 0.82 ALDH1A1 (0.51) ALDH1A1GLATSHRTDP1TP53
SCHEMBL8118094 0.82 ALDH1A1 (0.51) ALDH1A1GLATSHRTDP1TP53
SCHEMBL5901078 0.82 ALDH1A1 (0.51) ALDH1A1GLATSHRTDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605937-B1 Antistatic resin composition DAISO CO LTD (JP) 1997-06-11 EP claimed
EP-0605937-A1 Antistatic resin composition DAISO CO., LTD. (JP) 1994-07-13 EP claimed
EP-0605937-B1 Antistatic resin composition DAISO CO LTD (JP) 1997-06-11 EP disclosed
US-5556916-A ACRYLONITRILE-BUTADIENE-STYRENE TERPOLYMER WITH POLYOXYETHYLENE GLYCOL POLYMER OR COPOLYMER ON RUBBER SUBSTRATE DAISO CO. LTD. (JP) 1996-09-17 US disclosed
EP-0605937-A1 Antistatic resin composition DAISO CO., LTD. (JP) 1994-07-13 EP disclosed
US-5036077-A Antiseptics, preservatives, drugs, cosmetics, foods SANOFI (FR) 1991-07-30 US disclosed