SCHEMBL8153552

SCHEMBL8153552

O=C(O)c1[nH]c2c(c1Br)CCC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.45
HCAR2 Q8TDS4 2/20 0.42
GPR35 Q9HC97 1/20 0.40
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.37
HSD17B10 Q99714 4/20 0.36
ALOX15 P16050 3/20 0.36
USP2 O75604 2/20 0.36
MAPK1 P28482 2/20 0.36
MEN1 O00255 1/20 0.36
IKBKB O14920 1/20 0.36
TP53 P04637 1/20 0.36
MAPK10 P53779 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL8153488 0.78 PTK2 (0.46) PTK2HCAR2MAPTALDH1A1GFER
SCHEMBL8144806 0.77 PTK2 (0.45) PTK2HCAR2MAPTALDH1A1GFER
SCHEMBL8153549 0.77 PTK2 (0.62) PTK2HCAR2GPR35MAPTALDH1A1
SCHEMBL24482708 0.75 USP2 (0.51) MAPTALDH1A1KMT2ATSHRHSD17B10
SCHEMBL24482839 0.74 USP2 (0.50) MAPTALDH1A1KMT2ATSHRHSD17B10
SCHEMBL7826327 0.73 PTK2 (0.57) PTK2HCAR2MAPTALDH1A1GFER
SCHEMBL8153490 0.73 PTK2 (0.41) PTK2HCAR2MAPTALDH1A1GFER
SCHEMBL12777407 0.70 GPR35 (0.38) GPR35TSHRHSD17B10ALOX15
SCHEMBL8151495 0.70 GPR35 (0.38) GPR35TSHRHSD17B10ALOX15
SCHEMBL12777401 0.69 GPR35 (0.37) PTK2HCAR2GPR35ALDH1A1KMT2A

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 8 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
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-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2009-04-16 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 1248/4885HCAR2 2765/4885GPR35 3797/4885
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE PTK2 1248/4885HCAR2 2765/4885GPR35 3797/4885

“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.