SCHEMBL7394246

SCHEMBL7394246

CCCCCCC(Sc1nc2ccccc2o1)C(=O)NO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TP53 P04637 1/20 0.54
HSP90AA1 P07900 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
F2 P00734 1/20 0.50
LMNA P02545 1/20 0.50
MIF P14174 1/20 0.50
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
ADAM17 P78536 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
FAAH O00519 2/20 0.43
CES1 P23141 1/20 0.43
RAB9A P51151 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
Hydroxyamine SCHEMBL7072245 0.85 KMT2A (0.55) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL7072244 0.84 ALDH1A1 (0.59) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL10890199 0.77 KMT2A (0.50) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL7393604 0.76 PPARA (0.58) HSD17B10LMNA
SCHEMBL7395585 0.76 LMNA (0.55) ALDH1A1KMT2ALMNAMMP9MMP13
SCHEMBL10762557 0.74 ATM (0.55) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL10644906 0.73 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL11017110 0.73 KMT2A (0.54) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL10763229 0.73 L3MBTL1 (0.62) ALDH1A1KMT2AMAPTHSD17B10TP53
SCHEMBL9303603 0.73 KMT2A (0.48) ALDH1A1KMT2AMAPTHSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1784419-A Streptococcus agalactiae antigens I and II INTERCELL AG (AT) 2006-06-07 CN claimed
CN-1252790-A N-hydroxy-2-(alkyl, aryl or heteroaryl sulfanyl, sulfinyl or sulfonyl)-3-substituted alkyl, aryl or heteroarylamides as matrix metalloproteinase inhibitors AMERICAN CYANAMID CO (US) 2000-05-10 CN claimed
CN-1784419-A Streptococcus agalactiae antigens I and II INTERCELL AG (AT) 2006-06-07 CN disclosed
US-6172057-B1 ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2001-01-09 US disclosed