SCHEMBL3661223

SCHEMBL3661223

Nc1ccccc1NC(=O)c1ccc(OCCNC(=O)c2cc3ccc(C(F)(F)F)cc3o2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 5/20 0.56
HDAC1 Q13547 12/20 0.56
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PTGS1 P23219 2/20 0.53
KDM1A O60341 1/20 0.49
HDAC3 O15379 4/20 0.48
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL3663604 0.91 HDAC2 (0.55) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3659009 0.89 HDAC2 (0.71) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3660157 0.88 HDAC2 (0.54) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3660722 0.88 HDAC2 (0.55) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3663432 0.87 HDAC1 (0.60) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3664762 0.87 HDAC1 (0.60) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3665620 0.87 HDAC2 (0.58) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3661503 0.86 HDAC1 (0.61) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3665701 0.86 HDAC1 (0.63) HDAC2HDAC1HPGDTSHRSMN1; SMN2
SCHEMBL3660130 0.86 HDAC2 (0.70) HDAC2HDAC1HPGDTSHRSMN1; SMN2

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 3 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 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 1/4885HPGD 742/4885

“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.