SCHEMBL6976978

SCHEMBL6976978

COc1ccc(C(=O)N2CCNc3ccccc32)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.62
PDE4B Q07343 1/20 0.62
PDE4C Q08493 1/20 0.62
PDE4D Q08499 1/20 0.62
BCHE P06276 2/20 0.51
ACHE P22303 2/20 0.51
ALDH1A1 P00352 4/20 0.50
MCL1 Q07820 1/20 0.50
LMNA P02545 2/20 0.48
ROCK2 O75116 1/20 0.47
BRD4 O60885 1/20 0.46
BRD2 P25440 1/20 0.46
AVPR1A P37288 2/20 0.46
AVPR2 P30518 1/20 0.46
TLR8 Q9NR97 1/20 0.46
TLR7 Q9NYK1 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL10832384 0.82 ALDH1A1 (0.56) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL26088243 0.79 HTT (0.57) ALDH1A1BRD4AVPR1AAVPR2MAPT
SCHEMBL30379071 0.79 HTT (0.57) ALDH1A1BRD4AVPR1AAVPR2MAPT
SCHEMBL9606861 0.77 APP (0.52) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL26933868 0.77 AVPR1A (0.51) ALDH1A1BRD4AVPR1AAVPR2GAA
SCHEMBL30673873 0.77 AVPR1A (0.51) ALDH1A1BRD4AVPR1AAVPR2GAA
SCHEMBL29941834 0.77 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL30673867 0.76 HTT (0.62) ALDH1A1BRD4AVPR1AAVPR2GAA
SCHEMBL26933777 0.76 HTT (0.62) ALDH1A1BRD4AVPR1AAVPR2GAA
SCHEMBL6418688 0.76 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DBCHE

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-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-11-20 US disclosed
EP-1283055-A1 SOLUBLE BETA AMYLOID PRECURSOR PROTEIN SECRETION PROMOTERS Takeda Chemical Industries, Ltd. (JP) 2003-02-12 EP 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-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters APP, BDNF, BACE1 PDE4A 2235/4885PDE4B 2563/4885PDE4C 2811/4885

“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.