SCHEMBL4287094

SCHEMBL4287094

CCCCCCCCCCc1ccc(CN(C)C2CCC(C(=O)O)(C(=O)OCC)C2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
CNR2 P34972 6/20 0.32
CNR1 P21554 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.31
DRD4 P21917 1/20 0.31
NPY1R P25929 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
SLC22A1 O15245 1/20 0.31

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
SCHEMBL5795054 0.95 SPHK1 (0.33) POLBPKMLMNAMAPTMEN1
SCHEMBL4288416 0.94 DRD4 (0.33) POLBPKMLMNAMAPTCNR2
SCHEMBL4288406 0.94 DRD4 (0.33) POLBPKMLMNAMAPTCNR2
SCHEMBL4298739 0.93 TSHR (0.33) MAPTCNR2CNR1MEN1KMT2A
SCHEMBL5796210 0.92 TSHR (0.33) MAPTCNR2CNR1MEN1KMT2A
SCHEMBL4300194 0.92 SPHK1 (0.33) MAPTCNR2CNR1MEN1KMT2A
SCHEMBL4288626 0.92 SPHK1 (0.33) MAPTCNR2CNR1MEN1KMT2A
SCHEMBL4287267 0.91 CNR2 (0.34) POLBMAPTCNR2CNR1MEN1
SCHEMBL4287288 0.91 CNR2 (0.34) POLBMAPTCNR2CNR1MEN1
SCHEMBL4300068 0.89 SLC6A2 (0.37) POLBPKMLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US claimed
WO-2006043149-A9 NOVEL DICARBOXYLIC ACID DERIVATIVES BIOPROJET SOC CIV (FR) 2006-08-10 WO claimed
WO-2006043149-A2 NOVEL DICARBOXYLIC ACID DERIVATIVES BIOPROJET (FR) 2006-04-27 WO claimed
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US disclosed
WO-2006043149-A9 NOVEL DICARBOXYLIC ACID DERIVATIVES BIOPROJET SOC CIV (FR) 2006-08-10 WO disclosed
WO-2006043149-A2 NOVEL DICARBOXYLIC ACID DERIVATIVES BIOPROJET (FR) 2006-04-27 WO 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-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES S1PR2, S1PR1, S1PR5 POLB 4135/4885PKM 1438/4885LMNA 4220/4885

“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.