SCHEMBL4447345

SCHEMBL4447345

CC1OC(=O)N(c2ccc(-c3ccccc3)c(Cl)c2)C1C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.38
CSNK2A1 P68400 2/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
ADH5 P11766 1/20 0.35
STING1 Q86WV6 1/20 0.35
AR P10275 1/20 0.35
CTRC Q99895 2/20 0.35
RAD51 Q06609 1/20 0.35
FADS1 O60427 1/20 0.34
CYP2A6 P11509 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
SCHEMBL4454822 0.85 ESR2 (0.40) MEN1KMT2AADH5FADS1
SCHEMBL4458122 0.84 CALML3 (0.42) GRM2MEN1TSHRKMT2AFADS1
SCHEMBL4445382 0.83 DHODH (0.46) GRM2MEN1KMT2ACYP2A6
SCHEMBL4469782 0.83 ROCK2 (0.37) GRM2ADH5FADS1
SCHEMBL4474713 0.81 PDE3B (0.39) ADH5
SCHEMBL4460627 0.81 ALDH1A1 (0.43) GRM2TSHR
SCHEMBL4445293 0.80 ALDH1A1 (0.42) MEN1GAAKMT2A
SCHEMBL4472187 0.79 GRM2 (0.36) GRM2FADS1
SCHEMBL4444393 0.75 FADS1 (0.39) GRM2FADS1
SCHEMBL4455582 0.74 TNKS (0.39) GRM2

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-20090137577-A1 HETEROCYCLIC COMPOUNDS PFIZER INC. 2009-05-28 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-20090137577-A1 HETEROCYCLIC COMPOUNDS CYP2D6, ABCG2, CYP2B6 GRM2 4432/4885CSNK2A1 901/4885MEN1 526/4885

“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.