SCHEMBL4497294

SCHEMBL4497294

CCCN(CC1CC1)c1nc2ccc(OC)cc2cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.50
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL2395691 0.88 ALDH1A1 (0.41) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL4496282 0.84 ALDH1A1 (0.46) CRHR1ALDH1A1KDM4EGAAHPGD
SCHEMBL4510042 0.82 CRHR1 (0.50) CRHR1ALDH1A1KDM4EGAAMAPT
SCHEMBL13965584 0.74 CRHR1 (0.40) CRHR1
SCHEMBL2392414 0.73 ALDH1A1 (0.45) CRHR1ALDH1A1KDM4EGAAMAPT
SCHEMBL5623938 0.72 ALDH1A1 (0.46) ALDH1A1KDM4EGAAMAPTHPGD
SCHEMBL2393935 0.71 ALDH1A1 (0.45) ALDH1A1KDM4EGAAMAPTHPGD
SCHEMBL3039488 0.71 ALDH1A1 (0.46) ALDH1A1KDM4EMAPT
SCHEMBL4501540 0.71 CRHR1 (0.45) CRHR1
SCHEMBL4195023 0.70 ALDH1A1 (0.34) CRHR1ALDH1A1KDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023729-A1 Trisubstituted amine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-01-22 US disclosed
EP-1979341-A1 TRISUBSTITUTED AMINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-10-15 EP disclosed
WO-2007088999-A1 TRISUBSTITUTED AMINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-08-09 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-20090023729-A1 Trisubstituted amine compound CETP, MTTP, APOB CRHR1 3834/4885ALDH1A1 3188/4885KDM4E 418/4885

“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.