SCHEMBL4200537

SCHEMBL4200537

COc1ccc(N(Cc2cccnc2)c2cccc(S(=O)(=O)N3CCN(C)CC3)c2)cc1OC1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.56
PDE4D Q08499 7/20 0.56
PDE4B Q07343 6/20 0.56
PDE4C Q08493 5/20 0.56
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.43
GRM2 Q14416 3/20 0.42
CTSD P07339 1/20 0.42
BACE1 P56817 1/20 0.42
BACE2 Q9Y5Z0 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41

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
SCHEMBL4197440 0.94 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL4200808 0.92 PDE4A (0.56) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL4192741 0.90 KMT2A (0.44) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL4193194 0.86 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL4206692 0.85 PDE4A (0.51) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL4195438 0.83 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL1157499 0.83 PDE4B (0.50) PDE4APDE4DPDE4BPDE4C
SCHEMBL4204872 0.83 KMT2A (0.45) PDE4APDE4DPDE4BPDE4CKMT2A
SCHEMBL1157584 0.82 PDE4A (0.52) PDE4APDE4DPDE4BPDE4CCTSD
SCHEMBL1157704 0.82 PDE4A (0.61) PDE4APDE4DPDE4BPDE4CGRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048255-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS SCHUMACHER RICHARD A 2009-02-19 US claimed
EP-1539697-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS Memory Pharmaceutical Corporation (US) 2005-06-15 EP claimed
US-20050119225-A1 Phosphodiesterase 4 inhibitors, including N-substituted aniline and diphenylamine analogs MEMORY PHARMACEUTICALS CORP. (US) 2005-06-02 US claimed
WO-2004009552-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-01-29 WO claimed
US-20090048255-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS SCHUMACHER RICHARD A 2009-02-19 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 (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-20090048255-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS PDE4A, PDE4B, PDE3A PDE4A 1/4885PDE4D 8/4885PDE4B 2/4885
US-20050119225-A1 Phosphodiesterase 4 inhibitors, including N-substituted aniline and diphenylamine analogs PDE4A, PDE4B, PDE3A PDE4A 1/4885PDE4D 8/4885PDE4B 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.