SCHEMBL9257769

SCHEMBL9257769

CCC(O)N(CC)c1ccc(N)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.57
ESR1 P03372 2/20 0.37
AR P10275 1/20 0.37
ESR2 Q92731 1/20 0.37
ALDH1A1 P00352 4/20 0.37
CYP3A4 P08684 4/20 0.37
TDP1 Q9NUW8 4/20 0.37
TSHR P16473 2/20 0.37
SKP2 Q13309 1/20 0.37
S1PR1 P21453 6/20 0.34
IGLV6-57 P01721 1/20 0.34
RECQL P46063 2/20 0.33
ALOX15 P16050 2/20 0.33
GAA P10253 1/20 0.33
RAD52 P43351 1/20 0.33
THRB P10828 1/20 0.33
HIF1A Q16665 1/20 0.33
MAPK1 P28482 2/20 0.32
GFER P55789 2/20 0.32
PSMD14 O00487 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
Sulfuric Acid SCHEMBL9224591 0.93 S100B (0.50) S100BESR1ARESR2ALDH1A1
SCHEMBL9253281 0.88 S100B (0.54) S100BESR1ARESR2ALDH1A1
SCHEMBL793451 0.85 S100B (0.59) S100BESR1ARESR2ALDH1A1
SCHEMBL11114625 0.85 S100B (0.59) S100BESR1ARESR2ALDH1A1
Hydrochloric Acid SCHEMBL11575193 0.84 S100B (0.57) S100BESR1ARESR2ALDH1A1
SCHEMBL7032819 0.82 S100B (0.59) S100BESR1ARESR2ALDH1A1
SCHEMBL10798964 0.81 S100B (0.62) S100BESR1ARESR2ALDH1A1
SCHEMBL8983637 0.80 S100B (0.61) S100BESR1ARESR2ALDH1A1
Hydrochloric Acid SCHEMBL8385619 0.80 S100B (0.61) S100BESR1ARESR2ALDH1A1
SCHEMBL5699520 0.79 S100B (0.56) S100BESR1ARESR2ALDH1A1

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-1530081-B1 Photographic color developer solution and processing method by use thereof KONICA MINOLTA PHOTO IMAGING (JP) 2007-01-03 EP disclosed
US-5397689-A Hydroquinone compound to prevent fogging, fading and color mixing with good solubility and preservability FUJI PHOTO FILM CO., LTD. (JP) 1995-03-14 US disclosed