SCHEMBL18705830

SCHEMBL18705830

CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)c(C)c(-c4ccc(C)cc4)nc3c2)CC1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 19/20 0.73
▸ CACNA1B Q00975 1/20 0.48
▸ APBA1 Q02410 1/20 0.48

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
SCHEMBL18706122 0.94 SMYD3 (0.65) SMYD3
SCHEMBL18705736 0.93 SMYD3 (0.63) SMYD3
SCHEMBL20768879 0.93 SMYD3 (0.63) SMYD3
SCHEMBL18706325 0.93 SMYD3 (0.71) SMYD3
SCHEMBL18738631 0.92 SMYD3 (0.73) SMYD3
SCHEMBL18705857 0.91 SMYD3 (0.62) SMYD3
SCHEMBL18706492 0.91 SMYD3 (0.61) SMYD3CACNA1BAPBA1
SCHEMBL18706399 0.91 SMYD3 (0.61) SMYD3CACNA1BAPBA1
SCHEMBL20768807 0.90 SMYD3 (0.63) SMYD3CACNA1BAPBA1
SCHEMBL20781515 0.88 SMYD3 (0.68) SMYD3

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 4 patents. 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
US-20190071416-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-07 — — US disclosed
EP-3371151-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS Agency For Science, Technology And Research (SG) 2018-09-12 — — EP disclosed
WO-2017061957-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-04-13 — — WO 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 1/4885CACNA1B 4629/4885APBA1 3666/4885

“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