SCHEMBL2201286

SCHEMBL2201286

CCOC(=O)c1c(C)nn(-c2cccc(C(F)(F)F)c2)c1C

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.67
PDE4B Q07343 2/20 0.64
MAPT P10636 3/20 0.54
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
APP P05067 1/20 0.53
ADORA1 P30542 1/20 0.53
ALDH1A1 P00352 1/20 0.52
P2RY12 Q9H244 1/20 0.50
POLB P06746 2/20 0.49
TP53 P04637 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL2201029 0.90 PDE4D (0.53) PDE4DPDE4BMAPTLMNASMN1; SMN2
SCHEMBL2199384 0.86 PDE4D (0.67) PDE4DPDE4BMAPTALDH1A1P2RY12
SCHEMBL2201988 0.86 MAPT (0.50) PDE4DPDE4BMAPTLMNASMN1; SMN2
SCHEMBL2197562 0.86 MAPT (0.49) PDE4DPDE4BMAPTLMNASMN1; SMN2
SCHEMBL5904534 0.85 PDE4D (0.70) PDE4DPDE4BMAPTADORA1ALDH1A1
SCHEMBL2200430 0.85 MAPT (0.49) PDE4DPDE4BMAPTLMNASMN1; SMN2
SCHEMBL6070540 0.84 PDE4D (0.72) PDE4DPDE4BMAPTALDH1A1P2RY12
SCHEMBL2201222 0.84 PDE4D (0.67) PDE4DPDE4BMAPTALDH1A1P2RY12
SCHEMBL2202029 0.84 POLB (0.59) MAPTSMN1; SMN2POLBNPC1RAB9A
SCHEMBL6070622 0.84 PDE4D (0.76) PDE4DPDE4BMAPTALDH1A1P2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977358-B2 Pyrazol derivatives HOFFMANN-LA ROCHE INC. (US) 2011-07-12 US disclosed
EP-2182953-A2 NEW PYRAZOL DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-05-12 EP disclosed
US-20090029963-A1 PYRAZOL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-29 US disclosed
WO-2009013211-A2 NEW PYRAZOL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-29 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-20090029963-A1 PYRAZOL DERIVATIVES CCR1, CCR3, CCRL2 PDE4D 814/4885PDE4B 607/4885MAPT 4214/4885

“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.