SCHEMBL1153570

SCHEMBL1153570

CC(C)(O)[C@H](NC(=O)C1(C(=O)N[C@H](c2ccccc2)C(C)(C)O)CCCC1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 12/20 0.43
GPR88 Q9GZN0 1/20 0.40
MME P08473 1/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
OPRK1 P41145 1/20 0.37

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
SCHEMBL1153177 0.99 MAPK1 (0.42) MAPK1GPR88MMELMNAHPGD
SCHEMBL1152639 0.97 MAPK1 (0.43) MAPK1GPR88LMNAHPGDHTT
SCHEMBL1152381 0.94 MAPK1 (0.44) MAPK1GPR88LMNAHTTOPRK1
SCHEMBL1153772 0.86 MME (0.42) MAPK1MMELMNAHPGDHTT
SCHEMBL1153028 0.85 MME (0.41) MAPK1MMELMNAHPGDOPRK1
SCHEMBL1154265 0.84 LMNA (0.37) MMELMNAHPGDHTT
SCHEMBL1152964 0.83 HDAC4 (0.37) MMELMNAHPGDHTT
SCHEMBL1153646 0.83 MME (0.39) MAPK1MMELMNAHPGDHTT
SCHEMBL1153426 0.82 MME (0.42) GPR88MMELMNAHPGDHTT
SCHEMBL1153114 0.81 MME (0.41) MMEOPRK1

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-7943799-B2 Method for producing optically active cycloalkylidenebisoxazoline compound and intermediate thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-17 US disclosed
US-20110046415-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOALKYLIDENEBISOXAZOLINE COMPOUND AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-24 US disclosed
US-7842839-B2 Method for producing optically active cycloalkylidenebisoxazoline compound and intermediate thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-30 US disclosed
US-20070112201-A1 Method for producing optically active cycloalkylidenebisoxazoline compound and intermediate thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-17 US disclosed
EP-1698617-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOALKYLIDENE BISOXAZOLINE COMPOUND AND INTERMEDIATE THEREOF Sumitomo Chemical Company, Limited (JP) 2006-09-06 EP 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-20070112201-A1 Method for producing optically active cycloalkylidenebisoxazoline compound and intermediate thereof CYP3A7, GRK7, CYP2A7 MAPK1 2947/4885GPR88 1739/4885MME 4743/4885
US-20110046415-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOALKYLIDENEBISOXAZOLINE COMPOUND AND INTERMEDIATE THEREOF CYP3A7, GRK7, CYP2A7 MAPK1 2947/4885GPR88 1739/4885MME 4743/4885

“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.