SCHEMBL3129693

SCHEMBL3129693

CCOC(=O)Cc1cccc(N(Cc2cccnc2)c2ccc(OC(F)F)c(OC(F)F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 14/20 0.44
ALDH1A1 P00352 1/20 0.41
PDE4B Q07343 1/20 0.41
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
DHODH Q02127 1/20 0.36

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
SCHEMBL3122279 0.94 ALDH1A1 (0.43) GRM2ALDH1A1PDE4BJAK2JAK1
SCHEMBL3129231 0.92 PDE4B (0.38) GRM2PDE4B
SCHEMBL3118133 0.88 NAPRT (0.45) GRM2PDE4BLMNAPOLBMAPT
SCHEMBL1157272 0.87 MAPT (0.45) GRM2ALDH1A1PDE4BLMNAPOLB
SCHEMBL3207786 0.87 TRPM8 (0.35) GRM2PDE4BTRPM8
SCHEMBL3132285 0.83 GRM2 (0.43) GRM2ALDH1A1PDE4BLMNAPOLB
SCHEMBL3199280 0.83 PDE4B (0.36) ALDH1A1PDE4BLMNAMAPTKMT2A
SCHEMBL3203958 0.83 HRH4 (0.37) GRM2ALDH1A1PDE4BLMNAMAPT
SCHEMBL3218633 0.83 HRH4 (0.37) GRM2PDE4BJAK2JAK1LMNA
SCHEMBL1159028 0.82 GRM2 (0.44) GRM2PDE4BLMNAPOLBMAPT

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 2 patents. 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
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B GRM2 3498/4885ALDH1A1 190/4885PDE4B 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.