SCHEMBL6629432

SCHEMBL6629432

NC1[CH]Cc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.48
ANPEP P15144 2/20 0.42
KDM1A O60341 4/20 0.41
PLAU P00749 1/20 0.40
HRH1 P35367 2/20 0.39
RET P07949 1/20 0.39
HTR2C P28335 1/20 0.39
SIGMAR1 Q99720 1/20 0.37
IDO1 P14902 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
SCHEMBL4925778 0.77 HTR2A (0.45) HTR2AANPEPKDM1AHRH1RET
SCHEMBL3426562 0.71 HTR2A (0.38) HTR2AANPEPHRH1RETHTR2C
SCHEMBL5751646 0.71 HTR2A (0.38) HTR2AHRH1HTR2C
SCHEMBL3078945 0.71 HTR2A (0.38) HTR2AANPEPHRH1RETHTR2C
SCHEMBL5749663 0.71 HTR2A (0.38) HTR2AANPEPKDM1AHRH1RET
SCHEMBL6763552 0.71 HTR2A (0.38) HTR2AANPEPHRH1RETHTR2C
SCHEMBL528662 0.71 HTR2A (0.38) HTR2AANPEPHRH1RETHTR2C
SCHEMBL1030610 0.69 ALDH1A1 (0.42) HTR2AANPEPHRH1RETHTR2C
SCHEMBL6632659 0.67 PDPK1 (0.46) HTR2AHRH1HTR2CSIGMAR1
SCHEMBL11312986 0.67 PRCP (0.43) HTR2AHRH1HTR2C

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
EP-1317459-B1 BICYCLIC PYRROLYL AMIDES AS GLUCOGEN PHOSPHORYLASE INHIBITORS ASTRAZENECA AB (SE) 2004-04-07 EP disclosed
US-20030232875-A1 Bicyclic pyrrolyl amides as glucogen phosphorylase inhibitors ASTRAZENECA AB (SE) 2003-12-18 US 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-20030232875-A1 Bicyclic pyrrolyl amides as glucogen phosphorylase inhibitors GYS1, GYS2, PYGL HTR2A 3403/4885ANPEP 510/4885KDM1A 2560/4885

“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.