SCHEMBL4445149

SCHEMBL4445149

[CH2]CCS(=O)(=O)NCCC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.35
CA2 P00918 1/20 0.34
SIGMAR1 Q99720 1/20 0.32
REN P00797 1/20 0.31
HPGD P15428 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
SCHEMBL14919709 0.86 EPHX1 (0.38) EPHX1CA2SIGMAR1RENHPGD
SCHEMBL4443535 0.85 ACLY (0.35) EPHX1CA2SIGMAR1RENHPGD
SCHEMBL628815 0.80 CYP1A2 (0.44) EPHX1CA2SIGMAR1RENHPGD
SCHEMBL628897 0.77 SIGMAR1 (0.36) EPHX1CA2SIGMAR1RENHPGD
SCHEMBL1834640 0.75 CYP1A2 (0.47) EPHX1SIGMAR1REN
SCHEMBL628520 0.75 SIGMAR1 (0.34) EPHX1CA2SIGMAR1REN
SCHEMBL12077107 0.75 SIGMAR1 (0.53) CA2SIGMAR1REN
SCHEMBL8397068 0.75 CYP1A2 (0.35) EPHX1CA2SIGMAR1REN
SCHEMBL6565161 0.73 PSEN1 (0.35) CA2RENHPGD
SCHEMBL4439668 0.72 CYP1A2 (0.32) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 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-20080255153-A1 New compounds SCD, SCD5, FADS2 EPHX1 1600/4885CA2 2946/4885SIGMAR1 3291/4885

“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.