SCHEMBL3203192

SCHEMBL3203192

CCOc1ccc(N(Cc2cncnc2)c2ccc(C(=O)OC(C)(C)C)cc2)cc1OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 2/20 0.42
HDAC6 Q9UBN7 1/20 0.35
PPARG P37231 1/20 0.34
P2RX3 P56373 1/20 0.33
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL3202677 0.93 HDAC6 (0.36) RXRARXRBRXRGHDAC6ALDH1A1
SCHEMBL3210241 0.91 RXRA (0.39) RXRARXRBRXRGHDAC6P2RX3
SCHEMBL3126412 0.90 TSHR (0.42) HDAC6MAPTALDH1A1MAPK1
SCHEMBL3126325 0.89 RXRA (0.38) RXRARXRBRXRGHDAC6P2RX3
SCHEMBL3120590 0.88 LMNA (0.38) RXRARXRBRXRGHDAC6MAPT
SCHEMBL3212923 0.88 MAPK1 (0.39) HDAC6MAPTALDH1A1MAPK1
SCHEMBL3128439 0.88 RXRA (0.55) RXRARXRBRXRGPPARG
SCHEMBL3202834 0.87 RXRA (0.40) RXRARXRBRXRGHDAC6PPARG
SCHEMBL3120270 0.85 PDE4A (0.38) RXRARXRBRXRGHDAC6MAPT
SCHEMBL3218540 0.83 RXRA (0.40) RXRARXRBRXRGHDAC6PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 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-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.