SCHEMBL6350941

SCHEMBL6350941

CCOC(=O)CCc1cc(N)ccc1OC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.49
CYP4A11 Q02928 2/20 0.49
MAPK1 P28482 2/20 0.46
GAA P10253 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
DPP4 P27487 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAOB P27338 1/20 0.43
ADRA1A P35348 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
TLR7 Q9NYK1 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B2 P37059 1/20 0.41
FDPS P14324 1/20 0.41

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
Hydrochloric Acid SCHEMBL6976943 0.99 CYP4F2 (0.48) CYP4F2CYP4A11MAPK1GAAMAPT
SCHEMBL12426803 0.89 GAA (0.53) CYP4F2CYP4A11MAPK1GAAMAPT
SCHEMBL8550870 0.87 ADRA1A (0.45) MAPK1GAAMAPTALDH1A1ADRA1A
SCHEMBL2190989 0.85 DPP4 (0.49) MAPK1GAAMAPTKDM4EDPP4
SCHEMBL14874390 0.85 CYP4F2 (0.51) CYP4F2CYP4A11GAAKDM4EDPP4
SCHEMBL6035879 0.84 CYP4F2 (0.50) CYP4F2CYP4A11GAAKDM4EDPP4
SCHEMBL490458 0.84 HSD17B10 (0.55) CYP4F2CYP4A11KDM4EALDH1A1ADRA1A
SCHEMBL2691039 0.84 CYP4F2 (0.50) CYP4F2CYP4A11GAADPP4ALDH1A1
SCHEMBL17722574 0.83 CYP4F2 (0.54) CYP4F2CYP4A11GAAKDM4EDPP4
SCHEMBL10604296 0.83 CYP4F2 (0.49) CYP4F2CYP4A11GAAMAPTDPP4

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-20050090498-A1 3-Quinolin-2(1h)-ylideneindolin-2-one derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-04-28 US disclosed
EP-1396490-A1 3-QUINOLINE-2-(1H)-YLIDENEINDOLIN-2-ONE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-03-10 EP disclosed
US-20030078251-A1 Benzoxazepinones and their use as squalene synthase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-04-24 US disclosed
EP-1292585-A1 BENZOXAZEPINONES AND THEIR USE AS SQUALENE SYNTHASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-03-19 EP disclosed
WO-2001098282-A1 BENZOXAZEPINONES AND THEIR USE AS SQUALENE SYNTHASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD (JP) 2001-12-27 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-20050090498-A1 3-Quinolin-2(1h)-ylideneindolin-2-one derivative KDR, FLT4, FLT1 CYP4F2 3681/4885CYP4A11 3848/4885MAPK1 301/4885
US-20030078251-A1 Benzoxazepinones and their use as squalene synthase inhibitors SQLE, CYP17A1, ACOX1 CYP4F2 760/4885CYP4A11 71/4885MAPK1 2736/4885

“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.