SCHEMBL5115690

SCHEMBL5115690

COC(=O)C1(CN2CCC(CO)CC2)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
NPSR1 Q6W5P4 1/20 0.33
MAPT P10636 1/20 0.33
KDM1A O60341 1/20 0.32
ALOX5 P09917 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EPHX1 P07099 1/20 0.30

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
SCHEMBL5114016 0.87 HTR4 (0.35) CYP4F2CYP4A11
SCHEMBL1970718 0.87 CYP4F2 (0.40) CYP4F2CYP4A11NPSR1MAPTKDM1A
SCHEMBL1968493 0.84 CYP4F2 (0.37) CYP4F2CYP4A11KDM1ASMN1; SMN2
SCHEMBL1971371 0.79 DRD2 (0.43) SMN1; SMN2EPHX1
SCHEMBL2989855 0.78 DRD2 (0.43) SMN1; SMN2EPHX1
SCHEMBL24577446 0.77 CYP4F2 (0.46) CYP4F2CYP4A11NPSR1KDM1ASMN1; SMN2
SCHEMBL1973738 0.76 DRD2 (0.43) SMN1; SMN2EPHX1
SCHEMBL5114260 0.75 HTR4 (0.34) MAPTSMN1; SMN2
SCHEMBL31733064 0.74 CYP4F2 (0.37) CYP4F2CYP4A11SMN1; SMN2
SCHEMBL31733093 0.74 CYP4F2 (0.37) CYP4F2CYP4A11SMN1; SMN2

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-8816090-B2 Benzisoxazole derivatives PFIZER INC. (US) 2014-08-26 US disclosed
EP-1856114-B1 BENZISOXAZOLE DERIVATIVES PFIZER (US) 2014-08-20 EP disclosed
US-20080207690-A1 Benzisoxazole Derivatives RAQUALIA PHARMA INC. (JP) 2008-08-28 US disclosed
EP-1856114-A1 BENZISOXAZOLE DERIVATIVES Pfizer, Inc. (US) 2007-11-21 EP disclosed
WO-2006090224-A1 BENZISOXAZOLE DERIVATIVES PFIZER JAPAN INC. (JP) 2006-08-31 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-20080207690-A1 Benzisoxazole Derivatives BRS3, MRGPRX4, HTR4 CYP4F2 681/4885CYP4A11 451/4885NPSR1 30/4885

“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.