SCHEMBL18705667

SCHEMBL18705667

C=CCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)c4c(nc3c2)CCC4)CC1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 8/20 0.79
KMT2A Q03164 2/20 0.65
MAPT P10636 4/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
ALDH1A1 P00352 1/20 0.60
HTT P42858 1/20 0.60
RAB9A P51151 1/20 0.60
TP53 P04637 2/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59
HSD17B10 Q99714 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
SCHEMBL18738070 0.98 SMYD3 (0.79) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18706036 0.89 SMYD3 (1.00) SMYD3KMT2AMAPTALDH1A1HTT
SCHEMBL18706397 0.87 SMYD3 (1.00) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL20781464 0.85 SMYD3 (0.62) SMYD3KMT2AMAPTALDH1A1HTT
SCHEMBL18738641 0.84 SMYD3 (1.00) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18706372 0.83 SMYD3 (0.82) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18738519 0.83 SMYD3 (0.76) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18738513 0.83 SMYD3 (0.59) SMYD3KMT2AHSD17B10
SCHEMBL18706408 0.83 SMYD3 (1.00) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL20768803 0.80 SMYD3 (0.77) SMYD3KMT2AMAPTSMN1; SMN2ALDH1A1

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 1/4885KMT2A 29/4885MAPT 4633/4885

“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.