SCHEMBL18154848

SCHEMBL18154848

Nc1ccnc(Sc2ccc(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ MAPT P10636 5/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ DHFR P00374 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ JMJD7 P0C870 1/20 0.36

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
SCHEMBL18154788 0.87 KMT2A (0.40) MEN1KMT2AMAPTL3MBTL1SMN1; SMN2
SCHEMBL18154731 0.85 MAPT (0.56) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL18154795 0.84 NAMPT (0.38) MEN1KMT2AMAPTL3MBTL1SMN1; SMN2
SCHEMBL18154664 0.80 KMT2A (0.43) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL30353164 0.78 PIK3C3 (0.42) KMT2AMAPTLMNAALDH1A1RAB9A
SCHEMBL18154717 0.78 PIK3C3 (0.42) KMT2AMAPTLMNAALDH1A1RAB9A
SCHEMBL18154809 0.76 ALDH1A1 (0.39) MAPTL3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL30353158 0.76 ALDH1A1 (0.39) MAPTL3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL18154704 0.75 ALDH1A1 (0.34) MAPTL3MBTL1LMNAALDH1A1HTT
SCHEMBL18154756 0.74 CYP2C19 (0.41) MAPTL3MBTL1SMN1; SMN2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11612604-B2 Methods of treating cancer with PLK4 inhibitors LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2023-03-28 — — US disclosed
EP-3283482-A1 PLK4 INHIBITORS Ludwig Institute for Cancer Research Ltd (CH) 2018-02-21 — — EP disclosed
WO-2016166604-A1 PLK4 INHIBITORS LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2016-10-20 — — 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-11612604-B2 Methods of treating cancer with PLK4 inhibitors PLK4, PLK2, PLK3 MEN1 3546/4885KMT2A 1059/4885MAPT 3052/4885

“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.

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