SCHEMBL3973614

SCHEMBL3973614

CN(Cc1ccc(-c2ccc(O)c(Br)c2)cc1)C(=O)c1cn(C)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.45
HDAC1 Q13547 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 2/20 0.42
ERN1 O75460 1/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
HSP90AA1 P07900 2/20 0.40
NR4A2 P43354 3/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL3978498 0.89 HDAC1 (0.54) ROCK1HDAC1HDAC6LMNAMITF
SCHEMBL3974024 0.87 HTT (0.53) ROCK1HDAC1HDAC6HPGDLMNA
SCHEMBL3971810 0.86 HDAC1 (0.50) HDAC1HDAC6HPGDLMNAERN1
SCHEMBL3978851 0.82 ROCK1 (0.42) ROCK1HDAC1HDAC6HPGDLMNA
SCHEMBL3979138 0.79 ROCK1 (0.42) ROCK1HDAC1HDAC6HPGDMAPT
SCHEMBL27249469 0.77 LMNA (0.50) ROCK1HDAC1HDAC6LMNAMITF
SCHEMBL3973569 0.77 HDAC1 (0.51) ROCK1HDAC1HDAC6LMNAMAPT
SCHEMBL3973124 0.74 HTT (0.54) HDAC1HDAC6HPGDALDH1A1
SCHEMBL3978836 0.72 HDAC1 (0.47) ROCK1HDAC1HDAC6LMNAMAPT
SCHEMBL27249697 0.72 LMNA (0.57) LMNAMITFALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US disclosed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 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-20060020003-A1 Biphenyloxy-acids AHR, ARNT, NR1H4 ROCK1 4189/4885HDAC1 1929/4885HDAC6 1682/4885

“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.