SCHEMBL7189750

SCHEMBL7189750

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

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
CYP1A2 P05177 1/20 0.35
MTNR1A P48039 3/20 0.34
MTNR1B P49286 3/20 0.34
HMGCR P04035 1/20 0.32
DHODH Q02127 1/20 0.32

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
SCHEMBL7189707 0.94 ALOX5 (0.43) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7197220 0.90 NPC1 (0.40) ALOX5NPC1PKMRAB9AMTNR1A
SCHEMBL7198483 0.89 ALOX5 (0.40) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7193945 0.89 NPC1 (0.46) ALOX5NPC1PKMRAB9AMTNR1A
SCHEMBL7194097 0.88 PPARG (0.37) NPC1PKMRAB9A
SCHEMBL7195769 0.85 ALOX5 (0.38) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7196331 0.84 ALOX5 (0.39) ALOX5NPC1PKMRAB9ACYP1A2
SCHEMBL7197433 0.84 ALOX5 (0.40) ALOX5NPC1PKMRAB9AMTNR1A
SCHEMBL7190577 0.83 TAS1R3 (0.43) ALOX5NPC1RAB9AMTNR1AMTNR1B
SCHEMBL7193558 0.83 ALOX5 (0.43) 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.