SCHEMBL5276002

SCHEMBL5276002

O=C(O)c1cccc(OCCCNCCCc2nc3ccccc3o2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ GPBAR1 Q8TDU6 1/20 0.46
▸ CYSLTR1 Q9Y271 1/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ PPARA Q07869 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NR4A2 P43354 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ NR1H4 Q96RI1 2/20 0.41
▸ CETP P11597 1/20 0.41

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
SCHEMBL5271191 0.98 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5275354 0.97 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5273395 0.96 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5276150 0.96 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5273457 0.95 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5275532 0.94 TP53 (0.46) TP53MAPTGPBAR1CYSLTR1KMT2A
SCHEMBL5272902 0.89 TP53 (0.46) TP53MAPTKMT2ANPC1RAB9A
SCHEMBL5278464 0.88 PKM (0.45) TP53MAPTGPBAR1CYSLTR1NPC1
SCHEMBL5277813 0.85 PLA2G4B (0.46) TP53MAPTGPBAR1CYSLTR1NPC1
SCHEMBL5270863 0.85 TP53 (0.46) TP53MAPTCYSLTR1KMT2ANPC1

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-7301033-B2 PPAR-activating compound KOWA CO., LTD. (JP) 2007-11-27 — — US disclosed
EP-1857447-A1 PPAR-ACTIVATING COMPOUND Kowa Company, Ltd. (JP) 2007-11-21 — — EP disclosed
US-20060167058-A1 PPAR-activating compound KOWA CO., LTD. (JP) 2006-07-27 — — 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-20060167058-A1 PPAR-activating compound PPARA, PPARG, PPARD TP53 4064/4885MAPT 4734/4885GPBAR1 29/4885

“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.

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