SCHEMBL3760646

SCHEMBL3760646

CC(C)(C)OC(=O)N(C(=O)N1CCNCC1)c1cc[c]cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
MAPK1 P28482 2/20 0.35
GPR119 Q8TDV5 6/20 0.33
SIGMAR1 Q99720 1/20 0.33
SCN9A Q15858 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3763750 0.87 MAPT (0.38) HPGDMAPK1GPR119NPC1ALDH1A1
SCHEMBL3760642 0.81 MAPK1 (0.39) HPGDMAPK1GPR119SIGMAR1
SCHEMBL4002973 0.80 HRH2 (0.37) HPGDMAPK1NPC1ALDH1A1MAPT
SCHEMBL3762322 0.76 GAA (0.43) HPGDSIGMAR1ALDH1A1MAPTHTT
SCHEMBL8484073 0.72 MAPK1 (0.31) MAPK1GPR119SIGMAR1L3MBTL1
SCHEMBL2648822 0.72 NFKB1 (0.32)
SCHEMBL4657851 0.71 CA2 (0.35) HPGDMAPK1SIGMAR1
SCHEMBL4489637 0.70 TBXAS1 (0.42)
Water SCHEMBL27845952 0.70 USP2 (0.56) HPGDMAPK1GPR119MAPT
SCHEMBL28310488 0.69 PAX8 (0.46) MAPK1NPC1ALDH1A1HTTRAB9A

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
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 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 (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-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA HPGD 3366/4885MAPK1 178/4885GPR119 1143/4885

“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.