SCHEMBL5488642

SCHEMBL5488642

CCC1CCCCN1c1nc(C)nc2c1CCN2c1ccc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.46
NPY5R Q15761 3/20 0.45
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK4 Q16654 1/20 0.38
HSD11B1 P28845 1/20 0.38
GRM5 P41594 1/20 0.37
HPGD P15428 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HIF1A Q16665 1/20 0.36
KMT2A Q03164 2/20 0.36
CNR1 P21554 1/20 0.36
MAP2K7 O14733 1/20 0.36
MTOR P42345 1/20 0.35

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
SCHEMBL5494959 0.78 CRHR1 (0.47) CRHR1ALDH1A1KMT2ACNR1MEN1
SCHEMBL2193222 0.77 CRHR1 (0.49) CRHR1HPGDALDH1A1MAPTKMT2A
SCHEMBL3282113 0.74 CRHR1 (0.45) CRHR1CNR1
SCHEMBL5495262 0.73 CRHR1 (0.49) CRHR1CNR1
SCHEMBL5495271 0.72 CRHR1 (0.47) CRHR1
SCHEMBL5492052 0.72 CRHR1 (0.50) CRHR1
SCHEMBL6750144 0.72 CRHR1 (0.45) CRHR1
SCHEMBL5488979 0.72 CRHR1 (0.54) CRHR1KMT2AMEN1LMNA
SCHEMBL5494360 0.72 CRHR1 (0.48) CRHR1ALDH1A1MAPTKDM4ELMNA
SCHEMBL5496966 0.72 CRHR1 (0.55) CRHR1CNR1

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-7279474-B2 Substituted pyrrolo[2,3-d]pyrimidines as antagonists of the corticotropin releasing factor (CRF) GLAXO GROUP LIMITED (GB) 2007-10-09 US claimed
US-20040176400-A1 Fused pyrimidines as antagonists of the corticotropin releasing factor (crf) GLAXO GROUP LIMITED (GB) 2004-09-09 US claimed
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 2/4885NPY5R 17/4885PSEN1 3653/4885

“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.