SCHEMBL3272033

SCHEMBL3272033

c1ccc2c(c1)CCC2Oc1nc2ccccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.48
KCNN3 Q9UGI6 1/20 0.48
IDO1 P14902 2/20 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
SCHEMBL23123293 0.77 ALDH1A1 (0.48) IDO1
SCHEMBL21047719 0.72 KDM4C (0.42)
SCHEMBL30986408 0.70 LTA4H (0.45) IDO1
SCHEMBL3542838 0.69 KCNN3 (0.85) HDAC6KCNN3
SCHEMBL12017975 0.69 IDO1 (0.61) IDO1
SCHEMBL7857823 0.68 ALDH1A1 (0.58) IDO1
SCHEMBL376248 0.68 IDO1 (0.70) IDO1
SCHEMBL3544239 0.66 KCNN3 (0.62) HDAC6KCNN3
SCHEMBL9251890 0.66 PDE5A (0.48) IDO1
SCHEMBL10562594 0.66 IDO1 (0.45) IDO1

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
EP-1963311-B1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS RAQUALIA PHARMA INC (JP) 2010-06-16 EP disclosed
US-7723321-B2 Chromane substituted benzimidazole derivatives RAQUALIA PHARMA INC. (JP) 2010-05-25 US disclosed
EP-1963311-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS Pfizer, Inc. (US) 2008-09-03 EP disclosed
WO-2007072146-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS PFIZER JAPAN INC. (JP) 2007-06-28 WO disclosed
US-20070142448-A1 Chromane Substituted Benzimidazole Derivatives PFIZER INC. 2007-06-21 US disclosed
WO-2007031860-A1 INDANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS PFIZER JAPAN INC. (JP) 2007-03-22 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-20070142448-A1 Chromane Substituted Benzimidazole Derivatives HRH2, HRH4, HRH1 HDAC6 640/4885KCNN3 481/4885IDO1 3469/4885

“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.