SCHEMBL6322190

SCHEMBL6322190

COc1cc(-c2ncccc2CN2CCC(C(=O)O)CC2)cc(OC)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 3/20 0.49
PLK1 P53350 1/20 0.49
NEK1 Q96PY6 1/20 0.49
CD274 Q9NZQ7 4/20 0.48
PDCD1 Q15116 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
ALPL P05186 2/20 0.46
ALPI P09923 2/20 0.46
ALPG P10696 2/20 0.46
TP53 P04637 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SIGMAR1 Q99720 1/20 0.45
KDM4E B2RXH2 2/20 0.43
MITF O75030 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 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
SCHEMBL6319797 0.88 ALDH1A1 (0.57) L3MBTL1TP53MEN1KMT2AKDM4E
SCHEMBL5683742 0.86 MEN1 (0.49) TP53MEN1KMT2AKDM4EMAPK1
SCHEMBL5683863 0.82 MEN1 (0.46) TP53MEN1KMT2AKDM4EMAPK1
Maleic Acid SCHEMBL6328233 0.81 KDM4E (0.41) NEK2PLK1NEK1L3MBTL1ALPL
SCHEMBL4114501 0.80 NEK2 (0.52) NEK2PLK1NEK1CD274PDCD1
Fumaric Acid SCHEMBL6328236 0.80 THRB (0.44) TP53MEN1KMT2ALMNAMAPT
Hydrochloric Acid SCHEMBL6326446 0.76 ALDH1A1 (0.38) MEN1KMT2ASIGMAR1LMNA
Hydrochloric Acid SCHEMBL4763730 0.76 MEN1 (0.44) MEN1KMT2A
SCHEMBL28219784 0.76 POLB (0.67) CD274PDCD1MEN1KMT2ASIGMAR1
SCHEMBL6320232 0.75 KDM4E (0.44) ALPLALPIALPGTP53SIGMAR1

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-20050176764-A1 Medicine for treating cancer KOWA CO., LTD (JP) 2005-08-11 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-20050176764-A1 Medicine for treating cancer HDAC4, HDAC3, NR4A3 NEK2 205/4885PLK1 3665/4885NEK1 281/4885

“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.