SCHEMBL1245066

SCHEMBL1245066

CCOC(=O)c1cc2sc(CCc3ccccc3)cc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
MAPT P10636 6/20 0.51
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 5/20 0.51
HPGD P15428 5/20 0.51
NPC1 O15118 4/20 0.51
LMNA P02545 3/20 0.51
ATM Q13315 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
ALOX5 P09917 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
HSD17B10 Q99714 2/20 0.46
ALOX15 P16050 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
HTT P42858 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL4388481 0.89 KDM4E (0.52) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL1244830 0.84 DAO (0.48) MAPTALDH1A1KDM4EHPGDLMNA
SCHEMBL1244044 0.82 ALDH1A1 (0.50) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL15850382 0.82 ALDH1A1 (0.51) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL69116 0.79 HPGD (0.58) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL12906805 0.77 ADORA2A (0.36) RAB9ASMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL1244568 0.77 ALOX15 (0.55) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL1242507 0.76 TDP1 (0.46) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL18034454 0.76 ALDH1A1 (0.54) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL1244713 0.76 ALDH1A1 (0.54) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
WO-2008005456-A2 FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-10 WO disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 US disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 US disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 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-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase DAO, DDO, AOX1 RAB9A 2860/4885SMN1; SMN2 468/4885MAPT 2847/4885
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE DAO, DDO, AOX1 RAB9A 1945/4885SMN1; SMN2 796/4885MAPT 2384/4885

“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.