SCHEMBL15432258

SCHEMBL15432258

COC(=O)Nc1ccncc1C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.47
IL2 P60568 1/20 0.46
CHUK O15111 1/20 0.46
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
HSD17B10 Q99714 1/20 0.43
RCE1 Q9Y256 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.42
GLA P06280 1/20 0.41
IKBKE Q14164 1/20 0.41
TBK1 Q9UHD2 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL692100 0.86 HPGD (0.49) HPGDMEN1KMT2AMAPTPKM
SCHEMBL2107971 0.83 NAMPT (0.48) IL2RAB9A
SCHEMBL1043517 0.83 KDM4C (0.46) MEN1KMT2AMAPTPKMIL2
SCHEMBL4139383 0.81 ALDH1A1 (0.55) HPGDMEN1KMT2AIL2CHUK
SCHEMBL360914 0.81 KMT2A (0.51) HPGDMEN1KMT2AMAPTKDM4E
SCHEMBL15432244 0.81 KDM4E (0.56) HPGDMEN1KMT2AMAPTCHUK
SCHEMBL1128597 0.81 BCHE (0.49) HPGDMEN1KMT2AMAPTPKM
SCHEMBL17655428 0.80 SIRT3 (0.50) HPGDKMT2AMAPTPKMIL2
SCHEMBL5455954 0.79 ALDH1A1 (0.42) KMT2AMAPTIL2KDM4EALDH1A1
SCHEMBL15432248 0.77 KDM4E (0.51) HPGDMEN1KMT2AMAPTCHUK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140024621-A1 AMINOPYRIDINE COMPOUNDS AND THEIR USES MS THERAPEUTICS LIMITED (GB) 2014-01-23 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-20140024621-A1 AMINOPYRIDINE COMPOUNDS AND THEIR USES DNPEP, PEPD, ANPEP HPGD 320/4885MEN1 2266/4885KMT2A 1239/4885

“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.