SCHEMBL7196331

SCHEMBL7196331

CCCC(CC)Oc1cc(CCC(=O)c2cc(OC(CC)CCC)cc(OC(CC)CCC)c2OC(CC)CCC)c(OC(CC)CCC)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
CYP1A2 P05177 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HMGCR P04035 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARG P37231 2/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL7194985 0.90 NPC1 (0.40) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7193872 0.89 ALOX5 (0.39) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7198585 0.89 NPC1 (0.45) ALOX5NPC1PKMRAB9ATDP1
SCHEMBL7194731 0.88 PPARG (0.36) NPC1PKMRAB9ATDP1L3MBTL1
SCHEMBL7194222 0.85 ALOX5 (0.38) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7189750 0.84 ALOX5 (0.40) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7192510 0.83 TAS1R3 (0.42) ALOX5NPC1PKMRAB9ATDP1
SCHEMBL7189684 0.82 PPARG (0.42) NPC1PKMRAB9APPARGPPARD
SCHEMBL7189707 0.80 ALOX5 (0.43) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7196714 0.80 NPC1 (0.42) ALOX5NPC1PKMRAB9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones STATENS SERUM INSTITUTE (DK) 2003-04-03 US claimed

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones AKR1C3, AKR1C1, AKR1A1 ALOX5 1298/4885NPC1 3105/4885PKM 749/4885

“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.