SCHEMBL4919003

SCHEMBL4919003

CC1(C)CC(=O)c2c(S(C)(=O)=O)sc(C(=O)c3ccc(-c4ccccc4)cc3)c2C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.46
BRD4 O60885 2/20 0.43
ALDH1A1 P00352 4/20 0.41
PKM P14618 2/20 0.41
WRN Q14191 1/20 0.38
KMT2A Q03164 3/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 4/20 0.36
NPSR1 Q6W5P4 3/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL4924480 0.87 LRRK2 (0.47) LRRK2BRD4ALDH1A1PKMWRN
SCHEMBL4928068 0.87 LRRK2 (0.47) LRRK2ALDH1A1PKMWRNKMT2A
SCHEMBL14007312 0.85 LRRK2 (0.42) LRRK2BRD4ALDH1A1PKMKMT2A
SCHEMBL4917671 0.83 ALDH1A1 (0.42) LRRK2ALDH1A1PKMKMT2AMAPT
SCHEMBL4918991 0.82 ALDH1A1 (0.51) LRRK2BRD4ALDH1A1PKMWRN
SCHEMBL4929778 0.82 LRRK2 (0.45) LRRK2BRD4ALDH1A1PKMWRN
SCHEMBL4927681 0.82 LRRK2 (0.45) LRRK2BRD4ALDH1A1PKMLMNA
SCHEMBL4923124 0.81 LRRK2 (0.45) LRRK2ALDH1A1PKMKMT2AMAPT
SCHEMBL4917837 0.81 ALDH1A1 (0.43) LRRK2ALDH1A1PKMKMT2AMEN1
SCHEMBL4926093 0.81 ALDH1A1 (0.43) LRRK2ALDH1A1PKMMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275066-A1 Condensed Thiophene Derivatives and Their Use as Cyclic Glp-1 Agonists NOVO NORDISK A/S (DK) 2008-11-06 US disclosed
US-20080275066-A1 Condensed Thiophene Derivatives and Their Use as Cyclic Glp-1 Agonists NOVO NORDISK A/S (DK) 2008-11-06 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 (1 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-20080275066-A1 Condensed Thiophene Derivatives and Their Use as Cyclic Glp-1 Agonists GLP1R, GIPR, GCGR LRRK2 327/4885BRD4 726/4885ALDH1A1 2002/4885

“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.