SCHEMBL9788511

SCHEMBL9788511

CCOC(=O)c1cc2cccc(OCc3ccccc3)c2cc1OCCN1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
HTT P42858 1/20 0.49
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
ABCB1 P08183 1/20 0.48
BCHE P06276 1/20 0.47
LTA4H P09960 1/20 0.46
MET P08581 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NMT2 O60551 1/20 0.45
NMT1 P30419 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NPY1R P25929 1/20 0.45
DRD2 P14416 1/20 0.44
DRD1 P21728 1/20 0.44
DRD3 P35462 1/20 0.44

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
Hydrochloric Acid SCHEMBL9788535 0.99 ALDH1A1 (0.51) ALDH1A1HTTMEN1GAAKMT2A
SCHEMBL9788507 0.92 ABCB1 (0.52) MEN1GAAKMT2AABCB1NMT2
SCHEMBL10593191 0.92 PTPN1 (0.50) MEN1GAAKMT2ANMT2NMT1
Hydrochloric Acid SCHEMBL10527368 0.91 PTPN1 (0.49) MEN1GAAKMT2ANMT2NMT1
SCHEMBL9788513 0.85 NMT2 (0.47) HTTMEN1GAAKMT2ANMT2
SCHEMBL10526571 0.85 NMT2 (0.44) MEN1GAAKMT2ASMN1; SMN2NMT2
Hydrochloric Acid SCHEMBL9788506 0.84 NMT2 (0.46) HTTMEN1GAAKMT2ANMT2
SCHEMBL10391523 0.81 KMT2A (0.49) MEN1KMT2ANMT2NMT1
SCHEMBL9788539 0.80 DRD2 (0.54) ALDH1A1MEN1GAAKMT2AABCB1
SCHEMBL1681414 0.79 KMT2A (0.53) ALDH1A1HTTMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5015663-A Treatment of conditions requiring enhanced oxygen availability of mammalian tissues RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-05-14 US claimed