SCHEMBL3660370

SCHEMBL3660370

Nc1ccccc1NC(=O)c1ccc(OCCNC(=O)c2cc3c(OCCN4CCCC4)cccc3o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.53
HDAC1 Q13547 10/20 0.51
BRD4 O60885 1/20 0.51
JAK1 P23458 1/20 0.51
HDAC2 Q92769 3/20 0.45
KDM1A O60341 1/20 0.44
HDAC3 O15379 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
LTA4H P09960 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
SCHEMBL3662781 0.89 HDAC1 (0.52) MCHR1HDAC1BRD4JAK1HDAC2
SCHEMBL3662512 0.88 HDAC2 (0.50) HDAC1HDAC2KDM1AHDAC3HPGD
SCHEMBL3657400 0.88 HDAC1 (0.48) MCHR1HDAC1BRD4JAK1HDAC2
SCHEMBL3660109 0.87 HDAC1 (0.55) MCHR1HDAC1BRD4JAK1HDAC2
SCHEMBL3662677 0.87 HDAC1 (0.49) MCHR1HDAC1BRD4JAK1HDAC2
SCHEMBL3660386 0.87 HDAC1 (0.54) MCHR1HDAC1BRD4JAK1HDAC2
SCHEMBL3663309 0.86 HDAC1 (0.51) HDAC1HDAC2KDM1AHDAC3HPGD
SCHEMBL3665161 0.85 HDAC2 (0.53) HDAC1HDAC2KDM1AHDAC3HPGD
SCHEMBL3664963 0.85 HDAC1 (0.51) HDAC1HDAC2KDM1AHDAC3HPGD
SCHEMBL3664880 0.84 HDAC2 (0.55) MCHR1HDAC1BRD4JAK1HDAC2

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 MCHR1 4638/4885HDAC1 1/4885BRD4 70/4885

“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.