SCHEMBL20768768

SCHEMBL20768768

CC1CN(C(=O)c2ccc3c(Cl)cc(C4CC4)nc3c2)CCN1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 9/20 0.58
▸ MAPT P10636 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GHSR Q92847 7/20 0.43
▸ HTT P42858 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42

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
SCHEMBL20768767 1.00 SMYD3 (0.58) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL20768928 0.92 SMYD3 (0.53) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL20768930 0.92 SMYD3 (0.53) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL18705731 0.88 SMYD3 (0.59) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL20768974 0.88 SMYD3 (0.59) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL18705732 0.88 SMYD3 (0.59) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL18738629 0.86 SMYD3 (0.77) SMYD3
SCHEMBL20768982 0.85 SMYD3 (0.77) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL20768940 0.85 SMYD3 (0.77) SMYD3MAPTSMN1; SMN2GHSRHTT
SCHEMBL20768936 0.85 SMYD3 (0.77) SMYD3MAPTSMN1; SMN2GHSRHTT

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-20190071416-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-07 — — 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-20190071416-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS SMYD3, SMYD2, EHMT1 SMYD3 1/4885MAPT 4633/4885SMN1; SMN2 1700/4885

“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.

Send feedback