SCHEMBL5487155

SCHEMBL5487155

Cc1nc(O)c2c(n1)C(c1ccc(Cl)cc1Cl)CCC2

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.38
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
AGTR1 P30556 1/20 0.37
CRHR1 P34998 1/20 0.36
P2RX7 Q99572 2/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL5498704 0.93 TP53 (0.36) TP53GAATSHRAGTR1CRHR1
SCHEMBL3271338 0.88 TP53 (0.38) TP53GAATSHRAGTR1CRHR1
SCHEMBL5492086 0.80 TP53 (0.36) TP53GAATSHRAGTR1CRHR1
SCHEMBL5488607 0.77 CRHR1 (0.48) CRHR1
SCHEMBL5488619 0.75 CRHR1 (0.34) TP53CRHR1P2RX7
SCHEMBL5488610 0.75 CRHR1 (0.34) TP53CRHR1
SCHEMBL5488616 0.74 CRHR1 (0.33) TSHRCRHR1ALDH1A1
SCHEMBL5494540 0.74 SMN1; SMN2 (0.34) TP53GAATSHRAGTR1CRHR1
SCHEMBL5105876 0.72 TP53 (0.34) TP53GAATSHRAGTR1CRHR1
SCHEMBL3271633 0.70 CRHR1 (0.43) TP53CRHR1P2RX7

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 TP53 3584/4885GAA 2832/4885TSHR 406/4885

“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.