SCHEMBL4325328

SCHEMBL4325328

O=C(O)CCCCCc1nc(-c2ccccc2)c(-c2ccc(F)cc2)s1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.58
PTGDR2 Q9Y5Y4 5/20 0.50
LTB4R Q15722 1/20 0.47
PTGS1 P23219 1/20 0.46
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
NR4A2 P43354 1/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK14 Q16539 1/20 0.45
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
FAAH O00519 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
SCHEMBL4325159 1.00 PTGS2 (0.58) PTGS2PTGDR2LTB4RPTGS1RXRA
SCHEMBL4325418 0.93 MAPT (0.51) PTGS2LTB4RRXRARXRBNR4A2
SCHEMBL27046435 0.89 PTGS2 (0.58) PTGS2PTGDR2PTGS1RXRARXRB
SCHEMBL4320520 0.89 HDAC1 (0.55) PTGS2
SCHEMBL4322299 0.89 HDAC1 (0.55) PTGS2
SCHEMBL4341781 0.88 RXRA (0.48) PTGS2PTGDR2LTB4RRXRARXRB
SCHEMBL4335205 0.88 PTGDR2 (0.50) PTGS2PTGDR2RXRARXRBNR4A2
SCHEMBL4329770 0.88 RXRA (0.48) PTGS2PTGDR2LTB4RRXRARXRB
SCHEMBL4333120 0.88 PTGDR2 (0.50) PTGS2PTGDR2RXRARXRBNR4A2
SCHEMBL4322242 0.86 PTGS2 (0.54) PTGS2PTGDR2PTGS1SMN1; SMN2MAPK14

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-7521563-B2 Hydroxamic acid derivative and medicine containing the same as active ingredient SHIZUOKA COFFEIN CO., LTD. (JP) 2009-04-21 US disclosed
US-20070208065-A1 Hydroxamic Acid Derivative and Medicine Containing the Same as Active Ingredient SHIZUOKA COFFEIN CO., LTD. (JP) 2007-09-06 US disclosed
EP-1787986-A1 HYDROXAMIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME AS ACTIVE INGREDIENT SHIZUOKA COFFEIN CO., LTD. (JP) 2007-05-23 EP 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-20070208065-A1 Hydroxamic Acid Derivative and Medicine Containing the Same as Active Ingredient IL6, IL1A, TNF PTGS2 45/4885PTGDR2 1340/4885LTB4R 711/4885

“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.