SCHEMBL18706307

SCHEMBL18706307

CCCOC(=O)N1C(C)CN(C(=O)c2ccc3c(Cl)c4c(nc3c2)CCCC4)CC1C

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 15/20 0.78
ALDH1A1 P00352 1/20 0.61
HTT P42858 1/20 0.61
RAB9A P51151 1/20 0.61
KMT2A Q03164 1/20 0.61
MAPT P10636 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL18705776 0.93 SMYD3 (0.80) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18706223 0.91 SMYD3 (0.75) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18705708 0.91 SMYD3 (0.75) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18705841 0.90 SMYD3 (0.74) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18738716 0.89 SMYD3 (0.88) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18738728 0.87 SMYD3 (1.00) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL20781475 0.87 SMYD3 (1.00) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL20781687 0.87 SMYD3 (1.00) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18706128 0.87 SMYD3 (0.81) SMYD3ALDH1A1HTTRAB9AKMT2A
SCHEMBL18738641 0.87 SMYD3 (1.00) SMYD3ALDH1A1HTTRAB9AKMT2A

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 5 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
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 1/4885ALDH1A1 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.