SCHEMBL3120680

SCHEMBL3120680

CCOc1cc(N(Cc2cccnc2)c2ccc(C(=O)O)cc2)ccc1OC(F)F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 2/20 0.42
PDE4B Q07343 3/20 0.42
PDE4A P27815 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
GRM2 Q14416 2/20 0.41
DHODH Q02127 1/20 0.40
LMNA P02545 4/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL3132076 0.93 GRM2 (0.44) RXRAPDE4BPDE4APDE4CPDE4D
SCHEMBL3131461 0.92 PDE4A (0.47) RXRARXRBRXRGPDE4BPDE4A
SCHEMBL3132918 0.92 RXRA (0.45) RXRARXRBRXRGPDE4BPDE4A
SCHEMBL3123134 0.91 ALDH1A1 (0.46) PDE4BPDE4APDE4CPDE4DGRM2
SCHEMBL3121497 0.90 RXRA (0.48) RXRARXRBRXRGPDE4BPDE4A
SCHEMBL3123416 0.90 RXRA (0.44) RXRARXRBRXRGPDE4BPDE4A
SCHEMBL3131330 0.89 ALDH1A1 (0.46) PDE4BPDE4APDE4CPDE4DGRM2
SCHEMBL3120607 0.89 PDE4B (0.39) PDE4BPDE4APDE4CPDE4DGRM2
SCHEMBL4193526 0.89 L3MBTL1 (0.48) PDE4BPDE4APDE4CPDE4DGRM2
SCHEMBL3120236 0.88 PDE4D (0.58) RXRAPDE4BPDE4APDE4CPDE4D

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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US claimed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B RXRA 2856/4885RXRB 2676/4885RXRG 3004/4885

“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.