SCHEMBL7907421

SCHEMBL7907421

NC(=O)c1c(C(=O)O)ccc2c1C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
ALOX12 P18054 3/20 0.53
BRCA1 P38398 3/20 0.53
HSD17B10 Q99714 3/20 0.53
CYP2C9 P11712 2/20 0.53
ALOX15 P16050 2/20 0.53
FTO Q9C0B1 10/20 0.52
MAPT P10636 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
HTT P42858 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
CYP2C19 P33261 1/20 0.52
RECQL P46063 1/20 0.52
BLM P54132 1/20 0.52
SMAD3 P84022 1/20 0.52
PRMT1 Q99873 1/20 0.52
ACE2 Q9BYF1 1/20 0.52
LMNA P02545 2/20 0.36

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
SCHEMBL6037012 0.92 ALDH1A1 (0.56) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL6479542 0.87 FTO (0.58) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL8658740 0.86 FTO (0.57) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL8641482 0.85 HPGD (0.47) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL17515090 0.83 ALDH1A1 (0.55) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL20832 0.83 ALDH1A1 (0.60) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL25220939 0.83 HPGD (0.52) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL5766493 0.83 ALDH1A1 (0.52) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL29044412 0.82 ALDH1A1 (0.67) ALDH1A1HPGDALOX12BRCA1HSD17B10
SCHEMBL3730178 0.82 FTO (0.59) ALDH1A1HPGDALOX12BRCA1HSD17B10

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-118103710-A Compositions, kits and methods for detecting preclinical Alzheimer's disease 安元有限公司 2024-05-28 CN disclosed
US-6207389-B1 PROTEIN FOR THE DIAGNOSIS, TREATMENT AND PREVENTION OF DIABETES HRC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 2001-03-27 US disclosed
EP-0759035-A1 METHODS FOR CONTROLLING T LYMPHOCYTE MEDIATED IMMUNE RESPONSES HSC Research and Development Limited Partnership (CA) 1997-02-26 EP disclosed
WO-1995029936-A1 METHODS FOR CONTROLLING T LYMPHOCYTE MEDIATED IMMUNE RESPONSES HSC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 1995-11-09 WO disclosed