SCHEMBL4151641

SCHEMBL4151641

C=C(C)CC(C(C)=O)C(=O)NCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
POLB P06746 1/20 0.52
MMP8 P22894 3/20 0.50
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CNR1 P21554 1/20 0.48
KDM4A O75164 1/20 0.47
MEN1 O00255 2/20 0.47
TSHR P16473 1/20 0.47
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46

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
SCHEMBL4149806 0.84 POLB (0.64) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL4138386 0.81 MMP8 (0.65) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL4145237 0.81 POLB (0.57) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL4144621 0.78 MMP3 (0.50) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL3385526 0.77 KMT2A (0.59) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL10537039 0.76 POLB (0.57) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL1027805 0.75 SMN1; SMN2 (0.64) KMT2ACYP2C19ALDH1A1HPGDSMN1; SMN2
SCHEMBL7866857 0.75 KMT2A (0.81) KMT2ACYP2D6CYP2C9CYP2C19POLB
SCHEMBL4151569 0.75 POLB (0.64) KMT2ACYP2D6CYP2C9CYP2C19POLB
Hydrochloric Acid SCHEMBL27729415 0.73 KMT2A (0.78) KMT2ACYP2D6CYP2C9CYP2C19POLB

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-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 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-20090137557-A1 Calcilytic Compounds CALCR, SOST, CALCB KMT2A 4875/4885CYP2D6 1412/4885CYP2C9 1391/4885

“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.