SCHEMBL3213430

SCHEMBL3213430

CCOc1cc(N(Cc2cnco2)c2ccc(C(=O)O)cc2)ccc1OC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 14/20 0.40
HRH4 Q9H3N8 1/20 0.40
RXRB P28702 3/20 0.39
RXRG P48443 3/20 0.39
TSHR P16473 1/20 0.36
PPARG P37231 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
POLB P06746 1/20 0.35
CASP6 P55212 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NAMPT P43490 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
SCHEMBL3202322 0.91 RXRA (0.43) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3205618 0.91 NAMPT (0.46) RXRAHRH4AAK1POLBL3MBTL1
SCHEMBL3205215 0.89 AAK1 (0.37) RXRARXRBRXRGAAK1
SCHEMBL3192998 0.89 TSHR (0.46) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3123335 0.87 RXRA (0.42) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3200044 0.87 TSHR (0.52) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3194503 0.84 RXRA (0.53) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3246634 0.83 RXRA (0.49) RXRAHRH4RXRBRXRGTSHR
SCHEMBL3193794 0.83 MRGPRX4 (0.42) RXRAHRH4TSHRPPARGPOLB
SCHEMBL3209610 0.81 RXRA (0.46) RXRARXRBRXRGTSHRAAK1

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 7 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
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO 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 2856/4885HRH4 442/4885RXRB 2676/4885

“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.