SCHEMBL15190813

SCHEMBL15190813

CN(C)CCCNc1c(-c2cccs2)cnc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.56
NPC1 O15118 1/20 0.56
POLB P06746 1/20 0.56
SLC2A1 P11166 1/20 0.56
APOBEC3A P31941 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
FLT3 P36888 1/20 0.47
HRH3 Q9Y5N1 3/20 0.46
HRH1 P35367 2/20 0.46
TERT O14746 1/20 0.46
HRH2 P25021 1/20 0.46
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD2 P14416 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43

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
SCHEMBL528829 0.83 MELK (0.40) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL15190791 0.78 HIF1A (0.44) KMT2ATOP2A
SCHEMBL17450233 0.77 MET (0.39) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL15191305 0.77 RAD52 (0.66) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL31087715 0.73 RAD52 (1.00) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL4725486 0.73 RAD52 (1.00) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL530078 0.72 KMT2A (0.44) RAD52NPC1POLBSLC2A1APOBEC3A
SCHEMBL15191174 0.69 KMT2A (0.61) RAD52POLBKMT2AALDH1A1MAPK1
SCHEMBL529762 0.69 ACHE (0.42) POLBRAB9AALDH1A1DRD2ACHE
SCHEMBL530155 0.69 KMT2A (0.78) RAD52NPC1POLBSLC2A1APOBEC3A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9120749-B2 Quinoline derivatives and MELK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2015-09-01 US disclosed
US-9120749-B2 Quinoline derivatives and MELK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2015-09-01 US disclosed
US-9120749-B2 Quinoline derivatives and MELK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2015-09-01 US disclosed
US-20130217671-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2013-08-22 US disclosed
US-20130217671-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2013-08-22 US disclosed
US-20130217671-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2013-08-22 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-20130217671-A1 QUINOLINE DERIVATIVES AND MELK INHIBITORS CONTAINING THE SAME MELK, NADK, NEK1 RAD52 2014/4885NPC1 1911/4885POLB 2238/4885

“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.