SCHEMBL27969404

SCHEMBL27969404

CC(=O)Oc1ccccc1C(=O)OBr

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.67
KDM4E B2RXH2 3/20 0.67
LMNA P02545 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2C9 P11712 1/20 0.67
PTGS2 P35354 5/20 0.65
HPGD P15428 2/20 0.65
TSHR P16473 2/20 0.65
ALDH1A1 P00352 1/20 0.65
ESR1 P03372 1/20 0.65
ITGB3 P05106 1/20 0.65
ITGA2B P08514 1/20 0.65
HMGB1 P09429 1/20 0.65
GGT1 P19440 1/20 0.65
PTGS1 P23219 1/20 0.65
BLM P54132 1/20 0.65
NAPRT Q6XQN6 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
KMT2A Q03164 4/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL789771 0.85 HSD17B10 (0.71) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL10705752 0.85 HSD17B10 (0.71) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL29669847 0.85 HSD17B10 (0.71) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL5988737 0.85 HSD17B10 (0.71) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL11017487 0.84 PTGS2 (0.74) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL14972 0.83 HSD17B10 (0.69) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL30941613 0.83 KDM4E (0.69) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL1162463 0.83 KDM4E (0.69) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL8587601 0.82 KDM4E (0.63) HSD17B10KDM4ELMNACYP1A2CYP2C9
SCHEMBL15721292 0.81 HSD17B10 (0.67) HSD17B10KDM4ELMNACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104758253-A Technology for preparation of macromolecular microspheres NEXBIO INC 2015-07-08 CN disclosed
CN-103784408-A Technology for the preparation of microparticles ANSUN BIOPHARMA INC 2014-05-14 CN disclosed