SCHEMBL4375512

SCHEMBL4375512

CNC(=O)C(=O)CCCCCCCCc1cccc(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 11/20 0.50
HDAC2 Q92769 10/20 0.50
TAAR1 Q96RJ0 1/20 0.50
HDAC6 Q9UBN7 5/20 0.49
HDAC3 O15379 3/20 0.49
HDAC4 P56524 3/20 0.49
HDAC7 Q8WUI4 3/20 0.49
HDAC10 Q969S8 3/20 0.49
HDAC11 Q96DB2 3/20 0.49
HDAC8 Q9BY41 3/20 0.49
HDAC9 Q9UKV0 3/20 0.49
HDAC5 Q9UQL6 3/20 0.49
PLAAT3 P53816 2/20 0.48
PLAAT5 Q96KN8 2/20 0.48
PLAAT2 Q9NWW9 2/20 0.48
PLAAT4 Q9UL19 2/20 0.48

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
SCHEMBL2066307 0.80 MAPT (0.66) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL29676744 0.79 MAPT (0.62) HDAC1HDAC2TAAR1HDAC6HDAC3
SCHEMBL2067295 0.79 MAPT (0.62) HDAC1HDAC2TAAR1HDAC6HDAC3
SCHEMBL7373043 0.78 HDAC1 (0.72) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL19524669 0.78 TAAR1 (0.65) TAAR1
SCHEMBL30559640 0.77 TAAR1 (0.57) HDAC1HDAC2TAAR1HDAC6HDAC8
SCHEMBL7369298 0.76 HDAC1 (0.53) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL3397240 0.75 TAAR1 (0.50) TAAR1
SCHEMBL7109146 0.75 TAAR1 (0.50) HDAC1TAAR1HDAC6
SCHEMBL22190387 0.74 HDAC1 (0.67) HDAC1HDAC2HDAC6HDAC3HDAC4

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-8383652-B2 Biaromatic compounds that modulate PPAR-receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-02-26 US disclosed
US-20090012129-A1 NOVEL BIAROMATIC COMPOUNDS THAT MODULATE PPAR-RECEPTORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-01-08 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-20090012129-A1 NOVEL BIAROMATIC COMPOUNDS THAT MODULATE PPAR-RECEPTORS PPARG, PPARD, PPARA HDAC1 240/4885HDAC2 266/4885TAAR1 544/4885

“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.