SCHEMBL8209283

SCHEMBL8209283

O=C(Nc1cccc2ccccc12)N1CCC2(CC1)C(=O)N(c1ccccc1)C2c1ccccn1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 8/20 0.61
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
HSD17B10 Q99714 3/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
TRPV1 Q8NER1 7/20 0.49
TSHR P16473 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
SCHEMBL14263447 0.87 TRPV1 (0.63) CACNA1HKDM4EALDH1A1HSD17B10POLB
SCHEMBL14263465 0.81 CACNA1H (0.65) CACNA1HTRPV1
SCHEMBL14263483 0.80 CACNA1H (0.84) CACNA1HTRPV1
SCHEMBL8214513 0.80 KDM4E (0.60) CACNA1HKDM4EALDH1A1HSD17B10POLB
SCHEMBL8213176 0.79 TRPV1 (0.77) CACNA1HTRPV1
SCHEMBL14263423 0.79 TRPV1 (0.77) CACNA1HTRPV1
SCHEMBL8214078 0.76 CACNA1H (1.00) CACNA1H
SCHEMBL8210087 0.76 CACNA1H (0.91) CACNA1HALDH1A1HSD17B10TSHR
SCHEMBL8212424 0.75 CACNA1H (0.52) CACNA1HTRPV1
SCHEMBL14263421 0.75 CACNA1H (1.00) CACNA1HTRPV1

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-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
US-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
WO-2008033465-A1 AZETIDINONE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2008-03-20 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-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof LIPC, CES1, ZDHHC20 CACNA1H 2829/4885KDM4E 445/4885ALDH1A1 372/4885

“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.