SCHEMBL15088623

SCHEMBL15088623

O=C(/C=C/c1cc(NCc2ccccn2)ccc1Oc1ccc(F)cc1)NO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HDAC4 P56524 8/20 0.45
▸ HDAC8 Q9BY41 4/20 0.45
▸ HDAC1 Q13547 3/20 0.45
▸ HDAC3 O15379 2/20 0.45
▸ HDAC7 Q8WUI4 2/20 0.45
▸ HDAC2 Q92769 2/20 0.45
▸ HDAC10 Q969S8 2/20 0.45
▸ HDAC11 Q96DB2 2/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.45
▸ HDAC9 Q9UKV0 2/20 0.45
▸ HDAC5 Q9UQL6 2/20 0.45
▸ MEF2D Q14814 6/20 0.45
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ HPGD P15428 1/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ CYP1A2 P05177 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
SCHEMBL15066348 1.00 SCN9A (0.49) SCN9AKDM4EALDH1A1HDAC4HDAC8
SCHEMBL15065681 0.91 HDAC4 (0.45) SCN9AKDM4EALDH1A1HDAC4HDAC8
SCHEMBL15088667 0.91 HDAC4 (0.45) SCN9AKDM4EALDH1A1HDAC4HDAC8
SCHEMBL15088616 0.87 MAPT (0.45) KDM4EALDH1A1HDAC4HDAC8HDAC1
SCHEMBL15065747 0.87 MAPT (0.45) KDM4EALDH1A1HDAC4HDAC8HDAC1
SCHEMBL15088661 0.85 LMNA (0.46) KDM4EALDH1A1HDAC4HDAC8HDAC1
SCHEMBL15065752 0.85 LMNA (0.46) KDM4EALDH1A1HDAC4HDAC8HDAC1
SCHEMBL15066458 0.83 HDAC4 (0.51) SCN9AALDH1A1HDAC4HDAC8HDAC1
SCHEMBL15066206 0.83 HDAC4 (0.51) SCN9AALDH1A1HDAC4HDAC8HDAC1
SCHEMBL16443422 0.76 HDAC8 (0.47) SCN9AHDAC4HDAC8HDAC1HDAC3

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-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS LLC 2015-02-12 — — US claimed
CN-104136410-A CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS INC 2014-11-05 — — CN claimed
US-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS LLC 2015-02-12 — — US disclosed
US-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS LLC 2015-02-12 — — US disclosed
CN-104136410-A CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS INC 2014-11-05 — — CN disclosed
WO-2013101600-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS, INC. (US) 2013-07-04 — — 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-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 HDAC8, HDAC5, HDAC7 SCN9A 2313/4885KDM4E 781/4885ALDH1A1 688/4885

“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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