SCHEMBL4465442

SCHEMBL4465442

CCOc1cc([C@@H]2CC(=O)N([C@@H](C)C(=O)Nc3cccc(C)n3)C2)ccc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ALOX15 P16050 1/20 0.37
MAPT P10636 4/20 0.36
NPC1 O15118 3/20 0.36
TP53 P04637 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GBA1 P04062 1/20 0.36
CSF1R P07333 1/20 0.35
HSD17B10 Q99714 2/20 0.35
PDE4D Q08499 1/20 0.35
GRM5 P41594 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PDE4B Q07343 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL4457384 1.00 TSHR (0.41) TSHRALOX15MAPTNPC1TP53
SCHEMBL4465398 0.85 SMN1; SMN2 (0.42) TSHRALOX15MAPTNPC1TP53
SCHEMBL4466836 0.84 MEN1 (0.39) TSHRMAPTTP53SMN1; SMN2LMNA
SCHEMBL4476281 0.84 MEN1 (0.39) TSHRMAPTTP53SMN1; SMN2LMNA
SCHEMBL4471589 0.81 PDE4B (0.38) MAPTRAB9ALMNAPDE4DPDE4B
SCHEMBL4462080 0.81 PDE4B (0.38) MAPTRAB9ALMNAPDE4DPDE4B
SCHEMBL4476230 0.76 MAPK1 (0.43) TSHRMAPTSMN1; SMN2LMNANPSR1
SCHEMBL4476548 0.76 MAPK1 (0.43) TSHRMAPTSMN1; SMN2LMNANPSR1
SCHEMBL4466727 0.75 SMN1; SMN2 (0.48) TSHRALOX15MAPTTP53SMN1; SMN2
SCHEMBL3554084 0.74 PDE4A (0.48) TP53SMN1; SMN2PDE4DGRM5PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585882-B2 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION (US) 2009-09-08 US claimed
US-20090306156-A1 PHOSPHODIESTERASE 4 INHIBITORS HOPPER ALLEN 2009-12-10 US disclosed
US-20090306156-A1 PHOSPHODIESTERASE 4 INHIBITORS HOPPER ALLEN 2009-12-10 US disclosed
US-20090306156-A1 PHOSPHODIESTERASE 4 INHIBITORS HOPPER ALLEN 2009-12-10 US disclosed
US-7585882-B2 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION (US) 2009-09-08 US disclosed
US-7585882-B2 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION (US) 2009-09-08 US disclosed
US-7585882-B2 Phosphodiesterase 4 inhibitors MEMORY PHARMACEUTICALS CORPORATION (US) 2009-09-08 US disclosed
EP-1802615-A1 PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
US-20060135535-A1 4-(substituted-phenyl)-2-pyrrolidinones; reduced emetic side effects; antiinflammatory agents; neurological syndromes, asthma, arthritis MEMORY PHARMACEUTICALS CORPORATION 2006-06-22 US disclosed
WO-2006044955-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2006-04-27 WO disclosed
WO-2006044955-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 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 (2 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-20060135535-A1 4-(substituted-phenyl)-2-pyrrolidinones; reduced emetic side effects; antiinflammatory agents; neurological syndromes, asthma, arthritis PDE4A, PDE4B, PDE12 TSHR 2129/4885ALOX15 1143/4885MAPT 3363/4885
US-20090306156-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE3B, PDE5A TSHR 2737/4885ALOX15 2754/4885MAPT 4686/4885

“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.