SCHEMBL17258384

SCHEMBL17258384

N#Cc1cccc(-c2cccc(C(=O)O)n2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
ACMSD Q8TDX5 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ECE1 P42892 1/20 0.50
CES1 P23141 1/20 0.47
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
PADI1 Q9ULC6 1/20 0.43
PADI3 Q9ULW8 1/20 0.43
PADI4 Q9UM07 1/20 0.43
PADI2 Q9Y2J8 1/20 0.43
AHR P35869 1/20 0.43
CTSS P25774 1/20 0.42
LMNA P02545 1/20 0.40
DAGLA Q9Y4D2 1/20 0.40
EIF4E P06730 1/20 0.40

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
SCHEMBL1244495 0.89 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL29357675 0.83 KDM4E (0.76) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL70765 0.83 KDM4E (0.76) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL29355234 0.81 KDM4E (0.73) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL143651 0.81 KDM4E (0.73) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL9220648 0.81 CTSS (0.55) KDM4EALOX15TDP1CES1CTSS
SCHEMBL29988787 0.81 CTSS (0.55) KDM4EALOX15TDP1CES1CTSS
SCHEMBL17258380 0.81 CYP1A2 (0.43) CES1AHR
SCHEMBL5611442 0.80 KDM4E (0.55) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL23069157 0.79 KDM4E (0.70) KDM4EALOX15TSHRACMSDTDP1

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-9469656-B2 HDAC inhibitors as anti-cancer agents THE UNIVERSITY OF TOLEDO (US) 2016-10-18 US disclosed
US-20150329560-A1 HDAC Inhibitors as Anti-Cancer Agents THE UNIVERSITY OF TOLEDO (US) 2015-11-19 US disclosed
WO-2015175770-A1 HDAC INHIBITORS AS ANTI-CANCER AGENTS THE UNIVERSITY OF TOLEDO (US) 2015-11-19 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-20150329560-A1 HDAC Inhibitors as Anti-Cancer Agents HDAC1, HDAC4, HDAC5 KDM4E 188/4885ALOX15 3734/4885TSHR 4383/4885

“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.