SCHEMBL5488619

SCHEMBL5488619

CCCCC(C)(N)c1nc(C)nc2c1CCCC2c1ccc(Cl)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.34
BCHE P06276 1/20 0.31
P2RX7 Q99572 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL3271338 0.77 TP53 (0.38) CRHR1TP53
SCHEMBL5488607 0.77 CRHR1 (0.48) CRHR1
SCHEMBL5488616 0.77 CRHR1 (0.33) CRHR1BCHE
SCHEMBL5488610 0.76 CRHR1 (0.34) CRHR1TP53
SCHEMBL5487155 0.75 TP53 (0.38) CRHR1P2RX7TP53
SCHEMBL5496770 0.74 CRHR1 (0.42) CRHR1
SCHEMBL5492324 0.71 CRHR1 (0.49) CRHR1
SCHEMBL5492086 0.70 TP53 (0.36) CRHR1TP53
SCHEMBL5492323 0.69 CRHR1 (0.35) CRHR1
SCHEMBL5498704 0.68 TP53 (0.36) CRHR1P2RX7TP53

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
US-7279474-B2 Substituted pyrrolo[2,3-d]pyrimidines as antagonists of the corticotropin releasing factor (CRF) GLAXO GROUP LIMITED (GB) 2007-10-09 US disclosed
US-20040176400-A1 Fused pyrimidines as antagonists of the corticotropin releasing factor (crf) GLAXO GROUP LIMITED (GB) 2004-09-09 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-20040176400-A1 Fused pyrimidines as antagonists of the corticotropin releasing factor (crf) CRH, CRHR1, CRHR2 CRHR1 2/4885BCHE 1386/4885P2RX7 100/4885

“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.