SCHEMBL5324192

SCHEMBL5324192

O=C(O)CCCCCNc1cc(C(=O)O)cc2c1C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ BRCA1 P38398 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ FTO Q9C0B1 9/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ SMAD3 P84022 1/20 0.43
▸ PRMT1 Q99873 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ ALB P02768 1/20 0.39

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
SCHEMBL584155 0.91 HPGD (0.44) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL6037295 0.88 HPGD (0.48) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL10436328 0.85 FTO (0.44) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL3748733 0.79 HPGD (0.49) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL314241 0.77 ALB (0.51) HPGDALDH1A1FTOMEN1MAPT
SCHEMBL5872498 0.77 FTO (0.50) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL6530338 0.77 ALB (0.38) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL6531298 0.76 FTO (0.49) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL375100 0.76 FTO (0.49) HPGDALDH1A1CYP2C9ALOX15ALOX12
SCHEMBL19207355 0.76 HPGD (0.54) HPGDALDH1A1CYP2C9ALOX15ALOX12

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
US-20070293451-A1 Regulation ao ApoB by Hsp110 proteins and related compositions and methods UNIVERSITY OF PITTSBURGH (US) 2007-12-20 — — US claimed
WO-2007130403-A2 REGULATION OF ApoB BY Hspl 10 PROTEINS AND RELATED COMPOSITIONS AND METHODS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-11-15 — — WO claimed
US-20070293451-A1 Regulation ao ApoB by Hsp110 proteins and related compositions and methods UNIVERSITY OF PITTSBURGH (US) 2007-12-20 — — US disclosed
WO-2007130403-A2 REGULATION OF ApoB BY Hspl 10 PROTEINS AND RELATED COMPOSITIONS AND METHODS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-11-15 — — WO disclosed
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