SCHEMBL5113025

SCHEMBL5113025

Cc1nc(Cl)c2c(n1)N(c1ccc(C(F)(F)F)cc1C(F)(F)F)CC2CC=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.45
SRD5A1 P18405 2/20 0.33
TRAP1 Q12931 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HCAR1 Q9BXC0 1/20 0.32
P2RX7 Q99572 1/20 0.31
PHGDH O43175 1/20 0.31
HTR1A P08908 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
RBP4 P02753 1/20 0.31

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
SCHEMBL5113294 0.82 CRHR1 (0.41) CRHR1SRD5A1TRAP1
SCHEMBL5100161 0.82 CRHR1 (0.47) CRHR1SRD5A1TP53MAPTSMN1; SMN2
SCHEMBL5106990 0.80 CRHR1 (0.51) CRHR1SMN1; SMN2P2RX7
SCHEMBL5103520 0.78 CRHR1 (0.42) CRHR1SRD5A1TP53MAPTSMN1; SMN2
SCHEMBL2190889 0.76 CRHR1 (0.54) CRHR1SRD5A1TRAP1TP53MAPT
SCHEMBL5806699 0.76 CRHR1 (0.40) CRHR1TP53MAPTSMN1; SMN2HTR1A
SCHEMBL5055712 0.75 CRHR1 (0.40) CRHR1TP53MAPTSMN1; SMN2PHGDH
SCHEMBL5051889 0.72 CRHR1 (0.37) CRHR1RBP4
SCHEMBL5055764 0.70 CRHR1 (0.35) CRHR1
SCHEMBL5112592 0.69 CRHR1 (0.51) CRHR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329667-B2 A hexahydro-1,5,6,8-tetraaza-acenaphthylene or -1,3,4-triazaphenalene derivatives; treatment of depression and anxiety; inflammatory bowel disease; treatment of conditions mediated by corticotropin-releasing factor GLAXO GROUP LIMITED (GB) 2008-02-12 US disclosed
EP-1383498-B1 CRF RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2006-03-15 EP disclosed
US-20040235871-A1 Crf receptor antagonists GLAXO GROUP LIMITED (GB) 2004-11-25 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-20040235871-A1 Crf receptor antagonists CRHR1, CRHR2, CRH CRHR1 1/4885SRD5A1 763/4885TRAP1 3401/4885

“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.