SCHEMBL8997405

SCHEMBL8997405

CC(O)S(=O)(=O)Cc1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 4/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 1/20 0.50
TAS2R14 Q9NYV8 1/20 0.46
TP53 P04637 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
NR4A1 P22736 1/20 0.43
APEX1 P27695 1/20 0.43
APOBEC3A P31941 1/20 0.43

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
SCHEMBL10452515 0.88 KMT2A (0.40) ALDH1A1KMT2ATSHRHSD17B10POLB
SCHEMBL8778749 0.82 HSD17B10 (0.50) ALDH1A1KMT2ATSHRHSD17B10SMN1; SMN2
SCHEMBL1018465 0.81 ALDH1A1 (0.47) ALDH1A1KMT2ATSHRHSD17B10TAS2R14
SCHEMBL402122 0.79 KMT2A (0.59) ALDH1A1KMT2ATSHRHSD17B10TP53
SCHEMBL11581819 0.78 TSHR (0.58) ALDH1A1KMT2ATSHRHSD17B10TP53
SCHEMBL1018823 0.77 ALDH1A1 (0.61) ALDH1A1KMT2ATSHRHSD17B10TP53
SCHEMBL1060743 0.76 TSHR (0.56) ALDH1A1KMT2ATSHRHSD17B10TAS2R14
SCHEMBL11209267 0.76 POLB (0.46) ALDH1A1KMT2AHSD17B10SMN1; SMN2TDP1
SCHEMBL11209277 0.76 POLB (0.46) ALDH1A1KMT2AHSD17B10SMN1; SMN2TDP1
SCHEMBL27609587 0.76 KMT2A (0.45) ALDH1A1KMT2ATSHRHSD17B10TAS2R14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5500024-A DISCOLORATION INHIBITION; INTRAOCULAR AND CONTACT LENSES; BONDED TO POLYMER CIBA-GEIGY CORPORATION (US) 1996-03-19 US disclosed
US-5399692-A Ultraviolet absorbing benzophenone sulfonic acid derivatives CIBA-GEIGY CORPORATION (US) 1995-03-21 US disclosed
US-5298033-A An absorber bonded to lens formed of hydroxyethyl methacrylate CIBA-GEIGY CORPORATION (US) 1994-03-29 US disclosed