SCHEMBL7533938

SCHEMBL7533938

OCC=CC(O)C(O)CCCCO

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33

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
SCHEMBL3689402 0.93 FPR2 (0.30) FPR2NFKB1NFKB2RELA
SCHEMBL28159894 0.78 FPR2 (0.36) FPR2NFKB1NFKB2RELA
SCHEMBL29083300 0.78 TRPV1 (0.33) FPR2NFKB1NFKB2RELA
SCHEMBL18153861 0.74 LMNA (0.45)
SCHEMBL18153858 0.74 LMNA (0.45)
SCHEMBL17984921 0.73 MPI (0.38) FPR2NFKB1NFKB2RELA
SCHEMBL3399170 0.72 TRPV1 (0.41)
SCHEMBL11567483 0.72 MEN1 (0.31)
SCHEMBL21552032 0.72 FPR2 (0.39) FPR2NFKB1NFKB2RELA
SCHEMBL1506635 0.72 FPR2 (0.39) FPR2NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6371994-B2 HAIR DYES L'OREAL S.A. (FR) 2002-04-16 US claimed
US-20020004955-A1 DYE COMPOSITION FOR KERATIN FIBERS, WITH A CATIONIC DIRECT DYE AND A POLYOL OR POLYOL ETHER L' OREAL S.A. 2002-01-17 US claimed
US-4022605-A HALOCYANOACETAMIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JA) 1977-05-10 US claimed
US-5286476-A Conditioner containing high molecular weight polysiloxane and low boiling oil SHISEIDO COMPANY LTD. (JP) 1994-02-15 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-20020004955-A1 DYE COMPOSITION FOR KERATIN FIBERS, WITH A CATIONIC DIRECT DYE AND A POLYOL OR POLYOL ETHER KRT18, KRTCAP2, DSG1 FPR2 3482/4885NFKB1 3222/4885NFKB2 3885/4885

“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.