SCHEMBL20769036

SCHEMBL20769036

C[C@H]1CN(C(=O)O)CCN1C(=O)c1ccc2c(Cl)c3c(nc2c1)CCCC3

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 7/20 0.75
ALDH1A1 P00352 1/20 0.67
HTT P42858 1/20 0.67
MAPT P10636 6/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
KMT2A Q03164 2/20 0.63
MEN1 O00255 1/20 0.60
LMNA P02545 2/20 0.58
TP53 P04637 1/20 0.58

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
SCHEMBL18705892 1.00 SMYD3 (0.75) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL20768830 1.00 SMYD3 (0.75) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18706517 0.93 MAPT (0.71) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18706193 0.88 ALDH1A1 (0.66) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18705921 0.88 KMT2A (0.65) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL20769114 0.88 SMYD3 (0.77) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18706393 0.87 SMYD3 (0.61) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18706090 0.87 MAPT (0.60) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL18706303 0.86 MAPT (0.60) SMYD3ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL20781475 0.86 SMYD3 (1.00) SMYD3ALDH1A1HTTKMT2A

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 1/4885ALDH1A1 373/4885HTT 4168/4885

“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.