SCHEMBL8974583

SCHEMBL8974583

CCOC(=O)C1C=CC(=O)O1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
NLRP3 Q96P20 1/20 0.34
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL20537407 0.81 GAA (0.37) ALDH1A1GAA
SCHEMBL31668636 0.79 DNTT (0.34) ALDH1A1MAPT
SCHEMBL20246724 0.78 ALDH1A1 (0.33) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL1800075 0.75 TSHR (0.40) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL5308505 0.74 ALDH1A1 (0.46) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL23922439 0.72 GSK3A (0.41) TSHRALDH1A1KMT2AKDM4EGAA
SCHEMBL20246648 0.72 GSK3A (0.41) TSHRALDH1A1KMT2AKDM4EGAA
SCHEMBL19297948 0.71 PDCD4 (0.36) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL19297933 0.71 PDCD4 (0.36) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL19284482 0.71 PDCD4 (0.36) TSHRALDH1A1MEN1KMT2AMAPT

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-0695312-A1 IMMUNOPARTICLES BEARING MONOCLONAL ANTI-CD4 ANTIBODIES AND UTILISATION THEREOF LABORATOIRES UPSA (FR) 1996-02-07 EP disclosed
WO-1994024168-A1 IMMUNOPARTICLES BEARING MONOCLONAL ANTI-CD4 ANTIBODIES AND UTILISATION THEREOF LABORATOIRES UPSA (FR) 1994-10-27 WO disclosed