SCHEMBL18906952

SCHEMBL18906952

C=C(C)C(=O)N(CCS(=O)(=O)O)Cc1cccc(CN(CCS(=O)(=O)O)C(=O)C(=C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.38
GRIN3B O60391 5/20 0.38
GRIN1 Q05586 5/20 0.38
GRIN2A Q12879 5/20 0.38
GRIN2B Q13224 5/20 0.38
GRIN2C Q14957 5/20 0.38
GRIN3A Q8TCU5 5/20 0.38
PTGES O14684 4/20 0.36
CYP19A1 P11511 1/20 0.35
LIMK2 P53671 2/20 0.35
LIMK1 P53667 1/20 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
SCHEMBL18906944 0.79 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18906949 0.78 PTGS1 (0.31)
SCHEMBL9906098 0.77 LMNA (0.53)
SCHEMBL18913787 0.76 GRIN2D (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18913729 0.74 CYP19A1 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1629312 0.72 LMNA (0.55)
SCHEMBL15284755 0.72 HDAC3 (0.50) LIMK2
SCHEMBL22542298 0.70 ALDH1A1 (0.50)
SCHEMBL28301405 0.70 HDAC6 (0.54) LIMK2LIMK1
SCHEMBL11964294 0.69 HSD11B1 (0.46)

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-10005856-B2 Curable composition FUJIFILM CORPORATION (JP) 2018-06-26 US disclosed
EP-3187516-A1 CURABLE COMPOSITION, CURED PRODUCT OF FUNCTIONAL POLYMER, STACK OR DEVICE PROVIDED WITH FUNCTIONAL POLYMER FILM, AMIDE COMPOUND AND METHOD FOR PRODUCING SAME Fujifilm Corporation (JP) 2017-07-05 EP disclosed
US-20170152331-A1 CURABLE COMPOSITION, FUNCTIONAL POLYMER HARDENED PRODUCT, STACK OR DEVICE COMPRISING FUNCTIONAL POLYMER MEMBRANE, AMIDE COMPOUND, AND MANUFACTURING METHOD THEREOF FUJIFILM CORPORATION (JP) 2017-06-01 US disclosed
US-20170152331-A1 CURABLE COMPOSITION, FUNCTIONAL POLYMER HARDENED PRODUCT, STACK OR DEVICE COMPRISING FUNCTIONAL POLYMER MEMBRANE, AMIDE COMPOUND, AND MANUFACTURING METHOD THEREOF FUJIFILM CORPORATION (JP) 2017-06-01 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 (2 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-20170152331-A1 CURABLE COMPOSITION, FUNCTIONAL POLYMER HARDENED PRODUCT, STACK OR DEVICE COMPRISING FUNCTIONAL POLYMER MEMBRANE, AMIDE COMPOUND, AND MANUFACTURING METHOD THEREOF ASH2L, VMA21, SGMS1 GRIN2D 316/4885GRIN3B 514/4885GRIN1 115/4885
US-10005856-B2 Curable composition ASH2L, ASH1L, CHRM1 GRIN2D 885/4885GRIN3B 684/4885GRIN1 97/4885

“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.