SCHEMBL5261695

SCHEMBL5261695

CCCC1=C(NC(C(=O)O)C(CC)c2ccc(Oc3nccc4ccncc34)cc2)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
DRD1 P21728 1/20 0.34
GRM4 Q14833 2/20 0.31
PTGER4 P35408 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
SCN5A Q14524 1/20 0.30
SCN9A Q15858 1/20 0.30
ACACB O00763 1/20 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
SCHEMBL5259088 0.84 ITGB1 (0.41) FFAR1DRD1
SCHEMBL5262526 0.82 DRD1 (0.31) DRD1
SCHEMBL5147512 0.80 FFAR1 (0.38) FFAR1DRD1GRM4PTGER4CYP3A4
SCHEMBL5261691 0.79 DRD1 (0.36) FFAR1DRD1ACACB
SCHEMBL7259517 0.79 FFAR1 (0.38) FFAR1DRD1GRM4PTGER4CYP3A4
SCHEMBL5147705 0.79 FFAR1 (0.34) FFAR1DRD1
SCHEMBL5149383 0.78 FFAR1 (0.37) FFAR1DRD1GRM4PTGER4CYP3A4
SCHEMBL5261699 0.78 FFAR1 (0.35) FFAR1DRD1ACACB
SCHEMBL5148581 0.78 FFAR1 (0.36) FFAR1DRD1GRM4PTGER4CYP3A4
SCHEMBL5261700 0.78 FFAR1 (0.35) FFAR1DRD1ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1332132-B1 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES UCB PHARMA SA (BE) 2007-10-10 EP disclosed
US-20030229116-A1 ENAMINE DERIVATIVES UCB PHARMA S.A. (BE) 2003-12-11 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-20030229116-A1 ENAMINE DERIVATIVES ITGB2, CCR1, CCR10 FFAR1 172/4885DRD1 816/4885GRM4 1222/4885

“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.