SCHEMBL4309775

SCHEMBL4309775

CCOC1(c2ccccc2)COC(=O)N1Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 3/20 0.37
MDM2 Q00987 3/20 0.37
ELANE P08246 3/20 0.37
CTSG P08311 1/20 0.37
PRTN3 P24158 1/20 0.37
CYP2C19 P33261 4/20 0.36
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
AMPD2 Q01433 1/20 0.36
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL4319672 0.87 OPRM1 (0.37) SMN1; SMN2TP53MDM2ELANECTSG
SCHEMBL4309714 0.77 ELANE (0.42) ELANECTSGPRTN3CYP2C19OPRM1
SCHEMBL17446141 0.73 GSK3A (0.45) MDM2ELANECTSGPRTN3OPRL1
SCHEMBL4322743 0.72 CYP2C9 (0.38) TP53ELANECTSGPRTN3CYP2C19
SCHEMBL4329563 0.70 CHRM2 (0.36) TP53MDM2ELANECTSGPRTN3
SCHEMBL8475159 0.65 TSHR (0.36) SMN1; SMN2OPRL1GAA
SCHEMBL10994478 0.63 GAA (0.47) ELANECTSGPRTN3CYP2C19OPRM1
SCHEMBL4575028 0.62 ALDH1A1 (0.41) SMN1; SMN2OPRM1GAA
SCHEMBL28316609 0.62 ELANE (0.44) ELANECYP2C19GAAMEN1KMT2A
SCHEMBL28198953 0.61 CYP3A4 (0.38) SMN1; SMN2TP53MDM2ELANECYP2C19

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 SMN1; SMN2 902/4885TP53 570/4885MDM2 2457/4885

“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.