SCHEMBL6070076

SCHEMBL6070076

CCOC(=O)c1c(C)nn(-c2ccc(Br)cc2)c1C

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.76
P2RY12 Q9H244 2/20 0.63
ALDH1A1 P00352 2/20 0.58
PDE4B Q07343 2/20 0.57
SLC34A1 Q06495 1/20 0.53
HTT P42858 1/20 0.53
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
MAPT P10636 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GPR119 Q8TDV5 1/20 0.50

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
SCHEMBL6070059 0.89 PDE4D (0.80) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL16989389 0.87 PDE4D (0.78) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL6052477 0.86 PDE4D (0.76) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL4314951 0.86 PDE4D (1.00) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL8341970 0.86 P2RY12 (0.82) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL6069548 0.86 PDE4D (1.00) PDE4DP2RY12ALDH1A1PDE4BRAB9A
SCHEMBL15507086 0.85 PDE4D (0.78) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL4312926 0.85 PDE4D (1.00) PDE4DP2RY12ALDH1A1PDE4BSLC34A1
SCHEMBL6069484 0.84 PDE4D (0.72) PDE4DP2RY12ALDH1A1PDE4BRAB9A
SCHEMBL5904534 0.83 PDE4D (0.70) PDE4DP2RY12ALDH1A1PDE4BSLC34A1

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-7087634-B2 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION (US) 2006-08-08 US claimed
US-20030236412-A1 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION 2003-12-25 US claimed
US-6569885-B1 Such as 1-(4-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid ethyl ester; side effect reduction; for treatment of central nervous system disorders ICOS CORPORATION 2003-05-27 US claimed
US-7087634-B2 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION (US) 2006-08-08 US disclosed
US-20030236412-A1 Cyclic AMP-specific phosphodiesterase inhibitors ICOS CORPORATION 2003-12-25 US disclosed
US-6569885-B1 Such as 1-(4-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid ethyl ester; side effect reduction; for treatment of central nervous system disorders ICOS CORPORATION 2003-05-27 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-20030236412-A1 Cyclic AMP-specific phosphodiesterase inhibitors PDE4A, PDE4B, PDE7A PDE4D 5/4885P2RY12 302/4885ALDH1A1 1208/4885

“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.