SCHEMBL4363699

SCHEMBL4363699

CNC(=O)c1cccc(Oc2ccc(N)c(N)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.56
HDAC1 Q13547 9/20 0.56
HDAC8 Q9BY41 8/20 0.56
HDAC6 Q9UBN7 7/20 0.56
HDAC3 O15379 6/20 0.56
HDAC4 P56524 6/20 0.56
HDAC7 Q8WUI4 6/20 0.56
HDAC2 Q92769 6/20 0.56
HDAC10 Q969S8 6/20 0.56
HDAC11 Q96DB2 6/20 0.56
HDAC9 Q9UKV0 6/20 0.56
HDAC5 Q9UQL6 6/20 0.56
F10 P00742 2/20 0.52
F2 P00734 1/20 0.52
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NR4A1 P22736 1/20 0.50
TNKS O95271 1/20 0.49

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
SCHEMBL4364086 0.87 HDAC8 (0.50) BRAFHDAC1HDAC8HDAC6HDAC3
SCHEMBL177761 0.87 HDAC8 (0.57) BRAFHDAC1HDAC8HDAC6HDAC3
SCHEMBL11698825 0.83 MEN1 (0.56) HDAC8F10HPGDNR4A1TNKS
SCHEMBL4364884 0.83 FFAR1 (0.53) BRAFHDAC1HDAC8HDAC6HDAC3
SCHEMBL7053844 0.83 HDAC8 (0.73) HDAC8HDAC6F10F2HPGD
SCHEMBL257694 0.82 MMP13 (0.71) HDAC8HDAC6F10F2HPGD
SCHEMBL30147470 0.81 GCK (0.59) BRAFHDAC1HDAC8HDAC6F10
SCHEMBL177676 0.79 FFAR1 (0.71) BRAFHDAC1HDAC8HDAC6HDAC3
SCHEMBL30147517 0.79 NPC1 (0.60) HDAC1HDAC8HDAC6F10F2
SCHEMBL9005661 0.78 AKR1C3 (0.68) BRAFHDAC1HDAC8HDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 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-20040209892-A1 Heterocyclic compounds and methods of use VHL, NQO1, HPGDS BRAF 612/4885HDAC1 283/4885HDAC8 661/4885

“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.