SCHEMBL5437278

SCHEMBL5437278

CCCCS(=O)(=O)N1CCCC2(CCN(c3ccccc3)C2=O)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.37
CYP3A4 P08684 3/20 0.37
CYP2C9 P11712 3/20 0.37
CYP2C19 P33261 3/20 0.37
USP2 O75604 2/20 0.37
ALDH1A1 P00352 2/20 0.37
METAP2 P50579 4/20 0.37
NPC1 O15118 1/20 0.37
USP30 Q70CQ3 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
EGLN1 Q9GZT9 4/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36
LIPE Q05469 1/20 0.35
RORC P51449 1/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL5426342 0.83 HPGD (0.51) ALDH1A1METAP2KMT2ARORCTSHR
SCHEMBL5430012 0.82 CYP3A4 (0.54) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5418480 0.79 CYP3A4 (0.40) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5429871 0.79 METAP2 (0.47) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5427031 0.79 CYP3A4 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5428089 0.77 CTSG (0.48) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5426313 0.77 HCRTR2 (0.39) CYP3A4CYP2C9OPRM1OPRL1MEN1
SCHEMBL5423718 0.76 TSHR (0.47) CYP1A2CYP3A4CYP2C9CYP2C19USP2
SCHEMBL5427827 0.76 DOCK5 (0.52) METAP2TSHR
SCHEMBL5427248 0.75 LIPE (0.58) CYP1A2CYP3A4CYP2C9CYP2C19USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US disclosed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 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 (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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 CYP1A2 909/4885CYP3A4 888/4885CYP2C9 428/4885

“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.