SCHEMBL9522871

SCHEMBL9522871

CC(=O)NC(Cc1ccc(O)c(I)c1I)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.43
FOLH1 Q04609 2/20 0.42
LMNA P02545 1/20 0.42
ALOX15 P16050 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
NFKB1 P19838 1/20 0.41
PTGS2 P35354 1/20 0.41
THPO P40225 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
ALB P02768 2/20 0.39
ITGB2 P05107 1/20 0.38
ICAM1 P05362 1/20 0.38
ITGAL P20701 1/20 0.38

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
SCHEMBL9522481 0.89 FOLH1 (0.41) FOLH1ALOX15ALBITGB2ICAM1
SCHEMBL9306542 0.83 FOLH1 (0.36) TNFFOLH1ALOX15KDM4EPTGS2
SCHEMBL16023701 0.76 TNF (0.47) TNFFOLH1LMNAALOX15KDM4E
SCHEMBL468855 0.75 FOLH1 (0.70) TNFFOLH1LMNATHRBITGB3
SCHEMBL468853 0.75 FOLH1 (0.70) TNFFOLH1LMNATHRBITGB3
SCHEMBL5319562 0.73 LMNA (0.54) LMNAALOX15KDM4EMAPTTHRB
SCHEMBL468823 0.73 MME (0.60) FOLH1LMNAALOX15KDM4EMAPT
SCHEMBL9787629 0.73 MME (0.60) FOLH1LMNAALOX15KDM4EMAPT
SCHEMBL328475 0.73 MME (0.60) FOLH1LMNAALOX15KDM4EMAPT
SCHEMBL29367167 0.73 MME (0.60) FOLH1LMNAALOX15KDM4EMAPT

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
US-5273885-A Using a polyiodothyronine analog of a phenyl compound containing a hydroxyl group ortho to an iodine SYNTEX (U.S.A.) INC. (US) 1993-12-28 US disclosed