SCHEMBL4923641

SCHEMBL4923641

O=C(NCc1ccccc1Br)c1cc2cc(Cl)ccc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.61
PRNP P04156 1/20 0.58
HDAC3 O15379 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC4 P56524 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
HDAC5 Q9UQL6 1/20 0.55
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 1/20 0.51
BCAT1 P54687 1/20 0.51
ADAMTS4 O75173 2/20 0.51

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
SCHEMBL4926141 0.86 TP53 (0.61) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL14270770 0.84 TP53 (0.59) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4916668 0.84 TP53 (0.72) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4921714 0.83 TP53 (0.58) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4927113 0.81 HDAC3 (0.64) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4929525 0.81 RAB9A (0.57) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4927547 0.80 TP53 (0.55) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL14270776 0.78 TP53 (0.60) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4924318 0.78 HDAC3 (0.54) TP53HDAC3HDAC1HDAC2HDAC4
SCHEMBL4925354 0.78 HDAC3 (0.69) TP53HDAC3HDAC1HDAC2HDAC4

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-20080039442-A1 Compounds With Kv4 Ion Channel Activity DEVGEN NV (BE) 2008-02-14 US claimed
EP-1838690-A2 COMPOUNDS WITH KV4 ION CHANNEL ACTIVITY Devgen N.V. (BE) 2007-10-03 EP claimed
WO-2006066879-A2 COMPOUNDS WITH KV4 ION CHANNEL ACTIVITY DEVGEN N.V. (BE) 2006-06-29 WO claimed
US-20080039442-A1 Compounds With Kv4 Ion Channel Activity DEVGEN NV (BE) 2008-02-14 US disclosed
US-20080039442-A1 Compounds With Kv4 Ion Channel Activity DEVGEN NV (BE) 2008-02-14 US disclosed
US-20080039442-A1 Compounds With Kv4 Ion Channel Activity DEVGEN NV (BE) 2008-02-14 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-20080039442-A1 Compounds With Kv4 Ion Channel Activity KCNA4, HCN4, KCNN4 TP53 4191/4885PRNP 3874/4885HDAC3 818/4885

“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.