SCHEMBL3662954

SCHEMBL3662954

CC1CNCCN1CN(CCOc1ccc(C(=O)Nc2ccccc2N)cc1)C(=O)c1cc2ccccc2o1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 4/20 0.46
HDAC1 Q13547 12/20 0.43
HDAC3 O15379 4/20 0.40
UTS2R Q9UKP6 1/20 0.39
ACHE P22303 1/20 0.39
MAOB P27338 1/20 0.39
TP53 P04637 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM1A O60341 1/20 0.38
BRD4 O60885 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL3658967 0.86 HDAC2 (0.46) HDAC2HDAC1HDAC3UTS2RACHE
SCHEMBL3662770 0.84 HDAC2 (0.51) HDAC2HDAC1HDAC3UTS2RTP53
SCHEMBL3657397 0.84 HDAC2 (0.48) HDAC2HDAC1HDAC3ACHEMAOB
SCHEMBL3664629 0.84 HDAC2 (0.49) HDAC2HDAC1HDAC3UTS2RNPC1
SCHEMBL3664966 0.84 HDAC2 (0.51) HDAC2HDAC1HDAC3UTS2RTP53
SCHEMBL3662956 0.83 HDAC1 (0.50) HDAC2HDAC1HDAC3KDM1ABRD4
SCHEMBL3664547 0.83 HDAC1 (0.45) HDAC2HDAC1HDAC3ACHEMAOB
SCHEMBL3665554 0.83 HDAC2 (0.47) HDAC2HDAC1HDAC3ACHEMAOB
SCHEMBL3663180 0.83 HDAC1 (0.51) HDAC2HDAC1HDAC3TP53NPC1
SCHEMBL3662676 0.83 HDAC2 (0.50) HDAC2HDAC1HDAC3ACHEMAOB

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 HDAC2 4/4885HDAC1 1/4885HDAC3 11/4885

“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.