SCHEMBL1005565

SCHEMBL1005565

O=C(O)c1cc2c([nH]1)CCC2CC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.38
KDM5B Q9UGL1 2/20 0.36
KDM5A P29375 1/20 0.36
MCL1 Q07820 1/20 0.33
KDM6B O15054 1/20 0.32
KDM4A O75164 1/20 0.32
KDM4D Q6B0I6 1/20 0.32
KDM3B Q7LBC6 1/20 0.32
HIF1AN Q9NWT6 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
ALOX15 P16050 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HCAR3 P49019 1/20 0.31
RHEB Q15382 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ASPH Q12797 1/20 0.30

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
SCHEMBL1003669 0.84 ALDH1A1 (0.36) SMN1; SMN2KDM4EL3MBTL1EPHX2
SCHEMBL12777375 0.80 SMN1; SMN2 (0.35) RAB9AALOX15NFKB1BLMSMN1; SMN2
SCHEMBL8159258 0.80 SMN1; SMN2 (0.35) RAB9AALOX15NFKB1BLMSMN1; SMN2
SCHEMBL2074449 0.79 ALOX15 (0.33) RAB9AALOX15NFKB1BLMSMN1; SMN2
SCHEMBL1004425 0.77 TDP1 (0.34) RAB9AALOX15NFKB1BLMSMN1; SMN2
SCHEMBL1003681 0.77 HCAR2 (0.42) ALOX15NFKB1BLMSMN1; SMN2
SCHEMBL12777445 0.75 DDB1 (0.44) ESR1ESR2KDM4EL3MBTL1
SCHEMBL1003853 0.75 DDB1 (0.44) ESR1ESR2KDM4EL3MBTL1
SCHEMBL12777457 0.73 DAO (0.40) HCAR3KDM4E
SCHEMBL1004485 0.73 DAO (0.40) HCAR3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
WO-2011011330-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-01-27 WO disclosed
WO-2011011330-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-01-27 WO disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
US-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2009-04-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE RAB9A 2295/4885KDM5B 1298/4885KDM5A 1098/4885
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE RAB9A 2295/4885KDM5B 1298/4885KDM5A 1098/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.