SCHEMBL6038152

SCHEMBL6038152

O=C(COCc1ccc(F)cc1)NCCCc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
LMNA P02545 4/20 0.49
PKM P14618 2/20 0.49
USP2 O75604 2/20 0.49
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
GFER P55789 1/20 0.45
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44

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
SCHEMBL5276612 0.95 MAPT (0.50) MAPTLMNAPKMRAB9ANPC1
SCHEMBL6038117 0.95 MAPT (0.49) MAPTLMNAPKMUSP2NPC1
SCHEMBL5285905 0.90 LMNA (0.48) MAPTLMNAPKMRAB9ANPC1
SCHEMBL5280994 0.88 LMNA (0.44) MAPTLMNAPKMRAB9ANPC1
SCHEMBL5277128 0.87 LMNA (0.47) MAPTLMNAPKMRAB9ANPC1
SCHEMBL5276893 0.84 LMNA (0.49) MAPTLMNARAB9ANPC1ALDH1A1
SCHEMBL6038385 0.84 ALDH1A1 (0.64) PKMHDAC3HDAC4HDAC1HDAC7
SCHEMBL5288481 0.82 ALDH1A1 (0.53) LMNAPKMHDAC1HDAC8FFAR1
SCHEMBL6037905 0.82 HDAC1 (0.54) LMNAPKMHDAC4HDAC1HDAC8
SCHEMBL6037982 0.82 HDAC1 (0.50) MAPTLMNAPKMHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 MAPT 3848/4885LMNA 851/4885PKM 2287/4885

“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.