SCHEMBL6410183

SCHEMBL6410183

O=C(NCCO)C(F)CF

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
PTGS1 P23219 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A2 O94788 1/20 0.32
ALDH2 P05091 1/20 0.32
ALDH1A3 P47895 1/20 0.32
CNR1 P21554 1/20 0.32
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL4293765 0.78
SCHEMBL27653266 0.74
SCHEMBL211942 0.70
SCHEMBL8895535 0.70 USP2 (1.00) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL3871043 0.70 USP2 (1.00) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL6732293 0.70 ALDH1A1 (0.64) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL14602775 0.70 USP2 (1.00) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL525215 0.69 ALDH1A1 (0.61) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL7325278 0.69 ALDH1A1 (0.61) USP2ALDH1A1MEN1MAPTKMT2A
SCHEMBL11290407 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101592-A1 Bicyclic pyrazolyl and imidazolyl compounds and uses thereof PFIZER INC. 2005-05-12 US 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-20050101592-A1 Bicyclic pyrazolyl and imidazolyl compounds and uses thereof CNR2, CNR1, GPR18 USP2 4399/4885ALDH1A1 1759/4885MEN1 3935/4885

“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.