SCHEMBL6037040

SCHEMBL6037040

CCCC=Cc1cccc(CO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ENPP2 Q13822 1/20 0.38
PKM P14618 1/20 0.37
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
KCNA3 P22001 2/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
PRKCI P41743 1/20 0.35
EGFR P00533 1/20 0.35
TLR8 Q9NR97 1/20 0.35
HDAC4 P56524 2/20 0.35

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
SCHEMBL2007721 0.87 TNNC1 (0.48) CYP4F2CYP4A11
SCHEMBL2007720 0.87 TNNC1 (0.48) CYP4F2CYP4A11
SCHEMBL15182005 0.86 CYP4F2 (0.47) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL29239895 0.86 HDAC4 (0.42) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL27875964 0.84 CYP4F2 (0.46) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL27776481 0.83 CYP4F2 (0.44) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL27776423 0.81 CYP4F2 (0.38) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL289616 0.81 PPARG (0.47) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL289617 0.81 PPARG (0.47) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2
SCHEMBL8436279 0.80 CYP4F2 (0.43) CYP4F2CYP4A11KDM4EALDH1A1SMN1; SMN2

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-20210346495-A1 METHODS AND COMPOSITIONS COMPRISING AN NFKB INHIBITOR AND AN ADJUVANT THE UNIVERSITY OF CHICAGO (US) 2021-11-11 US disclosed
US-9453226-B2 Protection of cells from Alu-RNA-induced degeneration and inhibitors for protecting cells UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2016-09-27 US disclosed
US-20060024691-A1 Novel pathways in the etiology of cancer BUCK INSTITUTE FOR AGE RESEARCH 2006-02-02 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-20210346495-A1 METHODS AND COMPOSITIONS COMPRISING AN NFKB INHIBITOR AND AN ADJUVANT NFKBIA, IKBKG, NFKB2 CYP4F2 4658/4885CYP4A11 3265/4885KDM4E 3061/4885

“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.