SCHEMBL4287372

SCHEMBL4287372

CCCCCCCc1ccc(-c2ccc(CN3CCC(C(=O)O)(C(=O)OCC)CC3)cc2F)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.52
LMNA P02545 1/20 0.42
S1PR1 P21453 2/20 0.42
S1PR3 Q99500 2/20 0.42
S1PR4 O95977 1/20 0.42
S1PR5 Q9H228 1/20 0.42
RARA P10276 1/20 0.42
RARG P13631 1/20 0.42
ALDH1A1 P00352 3/20 0.42
POLB P06746 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CHKA P35790 1/20 0.41
PKM P14618 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL5796299 0.98 RARB (0.50) RARBLMNAS1PR1S1PR3S1PR4
SCHEMBL4293946 0.92 RARB (0.58) RARBS1PR1S1PR3S1PR4S1PR5
SCHEMBL4300481 0.87 LMNA (0.53) LMNAS1PR1S1PR3S1PR4S1PR5
SCHEMBL5796908 0.83 RARB (0.36) RARBLMNAALDH1A1POLBMEN1
SCHEMBL4293459 0.81 LMNA (0.54) LMNAS1PR1S1PR3S1PR4S1PR5
SCHEMBL4295383 0.79 RARB (0.48) RARBS1PR1S1PR3S1PR4S1PR5
SCHEMBL4290004 0.77 MEN1 (0.41) LMNAALDH1A1POLBMEN1KMT2A
SCHEMBL4295372 0.77 MEN1 (0.41) LMNAALDH1A1POLBMEN1KMT2A
SCHEMBL5797072 0.77 S1PR1 (0.60) RARBS1PR1S1PR3S1PR4S1PR5
SCHEMBL4300178 0.77 S1PR1 (0.60) RARBS1PR1S1PR3S1PR4S1PR5

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-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US 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

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 RARB 2651/4885LMNA 4220/4885S1PR1 2/4885

“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.