SCHEMBL3663554

SCHEMBL3663554

Nc1ccccc1NC(=O)c1ccc(OCCNC(=O)c2cc3cccc(COc4ccccc4)c3o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
HDAC1 Q13547 13/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC3 O15379 2/20 0.52
HDAC6 Q9UBN7 1/20 0.44
KDM1A O60341 1/20 0.44
GPR35 Q9HC97 1/20 0.43
NPC1 O15118 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL3664230 0.92 HDAC2 (0.51) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3661190 0.91 HDAC2 (0.53) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3664543 0.91 HDAC2 (0.49) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3657262 0.91 SMN1; SMN2 (0.51) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3658903 0.90 HDAC2 (0.50) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3664620 0.89 HDAC2 (0.54) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3661035 0.89 HDAC1 (0.51) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3665583 0.89 HDAC2 (0.51) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3664949 0.89 HDAC2 (0.47) SMN1; SMN2HPGDTSHRHDAC1HDAC2
SCHEMBL3662608 0.88 HDAC2 (0.50) SMN1; SMN2HPGDTSHRHDAC1HDAC2

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-20100292320-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2010-11-18 US claimed
EP-2220066-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS Gilead Colorado, Inc. (US) 2010-08-25 EP claimed
WO-2009079391-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2009-06-25 WO claimed
US-20100292320-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2010-11-18 US disclosed
EP-2220066-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS Gilead Colorado, Inc. (US) 2010-08-25 EP disclosed
WO-2009079391-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2009-06-25 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-20100292320-A1 BENZOFURAN ANILIDE HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC7, HDAC5 SMN1; SMN2 2074/4885HPGD 742/4885TSHR 4127/4885

“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.