SCHEMBL2999717

SCHEMBL2999717

CCCC(C)(CC)C(=O)OC(C)(C)C1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.32
CHRM4 P08173 4/20 0.32
CHRM1 P11229 4/20 0.32
CHRM3 P20309 4/20 0.32
SSTR4 P31391 1/20 0.31
NAAA Q02083 1/20 0.30
CCR2 P41597 1/20 0.30
EPHX1 P07099 2/20 0.30

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
SCHEMBL15858412 0.90 CHRM2 (0.35) CHRM2CHRM4CHRM1CHRM3SSTR4
SCHEMBL18937957 0.82 MMP8 (0.32) CHRM2CHRM4CHRM1CHRM3
SCHEMBL16200766 0.81 CHRM2 (0.30) CHRM2CHRM4CHRM1CHRM3
SCHEMBL106966 0.80 FKBP1A (0.36) CHRM2CHRM4CHRM1CHRM3CCR2
SCHEMBL18802879 0.80 FKBP1A (0.36) CHRM2CHRM4CHRM1CHRM3CCR2
SCHEMBL18802861 0.80 FKBP1A (0.36) CHRM2CHRM4CHRM1CHRM3CCR2
SCHEMBL107891 0.78 FKBP1A (0.37) CHRM2CHRM4CHRM1CHRM3CCR2
SCHEMBL10243718 0.78 PDK1 (0.34) CHRM2CHRM4CHRM1CHRM3EPHX1
SCHEMBL21677330 0.78 NAAA (0.45) CHRM2CHRM1CHRM3NAAAEPHX1
SCHEMBL22373391 0.78 ARG1 (0.31)

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-20120003437-A1 PHOTOSENSITIVE COMPOSITION, PATTERN FORMING MATERIAL AND PHOTOSENSITIVE FILM USING THE SAME, PATTERN FORMING METHOD, PATTERN FILM, ANTIREFLECTION FILM, INSULATING FILM, OPTICAL DEVICE, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
US-20110089385-A1 COMPOSITION FOR OPTICAL MATERIALS FUJIFILM CORPORATION (JP) 2011-04-21 US disclosed
EP-1829850-A2 Fluoroalcohol preparation method, fluorinated monomer, polymer, resist composition and patterning process Shin-Etsu Chemical Co., Ltd. (JP) 2007-09-05 EP 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-20110089385-A1 COMPOSITION FOR OPTICAL MATERIALS ITGA1, PIEZO1, RPS4X CHRM2 271/4885CHRM4 704/4885CHRM1 84/4885

“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.