SCHEMBL6804562

SCHEMBL6804562

Cc1cc(C)c(-n2c(C)c(C)c3c(N4CCCC4)nc(C)nc32)c(C)c1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 8/20 0.80
TDP1 Q9NUW8 3/20 0.49
KDM4E B2RXH2 2/20 0.38
ALOX15 P16050 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
NPY5R Q15761 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
MAP2K7 O14733 1/20 0.37

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
SCHEMBL1636820 0.84 CRHR1 (0.67) CRHR1TDP1MAP2K7
SCHEMBL1637024 0.83 CRHR1 (0.60) CRHR1TDP1KDM4EALOX15CASP1
SCHEMBL12534721 0.83 CRHR1 (0.60) CRHR1TDP1MAP2K7
SCHEMBL1636150 0.81 CRHR1 (0.64) CRHR1TDP1KDM4EALOX15CASP1
SCHEMBL12534771 0.81 CRHR1 (0.64) CRHR1TDP1MAP2K7
SCHEMBL1636997 0.80 CRHR1 (0.62) CRHR1TDP1MAP2K7
SCHEMBL14536212 0.79 CRHR1 (0.60) CRHR1TDP1
SCHEMBL12593279 0.78 CRHR1 (0.60) CRHR1TDP1KDM4EHSD17B10MAPT
SCHEMBL1636376 0.77 CRHR1 (0.53) CRHR1TDP1KDM4EHSD17B10ALDH1A1
SCHEMBL1637910 0.77 CRHR1 (0.53) CRHR1TDP1NPY5RMAP2K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833378-B2 Pyridines, pyrimidines, purinones, pyrrolopyrimidinones and pyrrolopyridinones; useful in the treatment disorders including CNS and stress-related disorders. PFIZER INC 2004-12-21 US disclosed
EP-1263732-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Pfizer Products Inc. (US) 2002-12-11 EP disclosed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 US disclosed
WO-2001053263-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2001-07-26 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-20020016328-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 CRHR1 3/4885TDP1 4399/4885KDM4E 2820/4885

“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.