Hymecromone

Hymecromone

SCHEMBL28215495

CCCCCCCC(=O)O.Cc1cc(=O)oc2cc(O)ccc12

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.66
KDM4E B2RXH2 10/20 0.66
HPGD P15428 8/20 0.66
HSD17B10 Q99714 6/20 0.66
HSD17B3 P37058 6/20 0.66
GAA P10253 5/20 0.66
GLA P06280 5/20 0.66
CASP1 P29466 3/20 0.66
CASP7 P55210 3/20 0.66
AKR1B1 P15121 2/20 0.66
CA12 O43570 1/20 0.66
LMNA P02545 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP2C9 P11712 1/20 0.66
UGT1A1 P22309 1/20 0.66
MAOB P27338 1/20 0.66
KDR P35968 1/20 0.66
MCL1 Q07820 1/20 0.66
CA9 Q16790 1/20 0.66
KMT2A Q03164 3/20 0.58

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
Stearic Acid SCHEMBL28308815 1.00 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Palmitic Acid SCHEMBL5886483 1.00 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Oleic Acid SCHEMBL7041165 0.93 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Oleic Acid SCHEMBL28807513 0.93 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL5356260 0.91 ALDH1A1 (0.75) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL7594956 0.81 KDM4E (0.87) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL2357040 0.81 HSD17B3 (1.00) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL29364837 0.81 HSD17B3 (1.00) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL29624431 0.81 HSD17B3 (1.00) ALDH1A1KDM4EHPGDHSD17B10HSD17B3
Hymecromone SCHEMBL24150 0.81 HSD17B3 (1.00) ALDH1A1KDM4EHPGDHSD17B10HSD17B3

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
CN-108048307-A A kind of rapid detection system of blood infection microorganism 中国科学院苏州生物医学工程技术研究所 2018-05-18 CN claimed
CN-208023017-U A kind of rapid detection system of blood infection microorganism 中国科学院苏州生物医学工程技术研究所 2018-10-30 CN disclosed
CN-108048307-A A kind of rapid detection system of blood infection microorganism 中国科学院苏州生物医学工程技术研究所 2018-05-18 CN disclosed