SCHEMBL8157767

SCHEMBL8157767

Cc1c(C(=O)O)[nH]c2c1CCC2O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.38
GPR35 Q9HC97 2/20 0.37
HCAR2 Q8TDS4 2/20 0.35
HSD17B10 Q99714 2/20 0.33
GAA P10253 2/20 0.33
TSHR P16473 2/20 0.32
ALOX15 P16050 1/20 0.32
LMNA P02545 1/20 0.31
BRD3 Q15059 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
MCL1 Q07820 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL12777388 1.00 PTK2 (0.38) PTK2GPR35HCAR2HSD17B10GAA
SCHEMBL12777390 0.83 HCAR2 (0.49) PTK2GPR35HCAR2HSD17B10GAA
SCHEMBL8157761 0.83 HCAR2 (0.49) PTK2GPR35HCAR2HSD17B10GAA
SCHEMBL12777412 0.81 JAK2 (0.39) HCAR2BRD3
SCHEMBL12777408 0.79 GPR35 (0.37) GPR35HCAR2BRD3
SCHEMBL8153553 0.79 GPR35 (0.37) GPR35HCAR2BRD3
SCHEMBL12777396 0.79 HCAR2 (0.32) HCAR2BRD3
SCHEMBL13282780 0.76 PTK2 (0.34) PTK2GPR35HCAR2GAATSHR
SCHEMBL12777384 0.72 PTK2 (0.45) PTK2GPR35HSD17B10GAATSHR
SCHEMBL8159149 0.72 PTK2 (0.45) PTK2GPR35HSD17B10GAATSHR

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 5 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
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-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2009-04-16 US disclosed
WO-2008089453-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-07-24 WO 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 PTK2 1248/4885GPR35 3797/4885HCAR2 2765/4885
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE PTK2 1248/4885GPR35 3797/4885HCAR2 2765/4885

“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.