SCHEMBL3962349

SCHEMBL3962349

COCNC(=O)c1cc(C)nn2c(-c3sc4ccc(F)cc4c3C)c(C)nc12

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.60
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 2/20 0.40
PI4KB Q9UBF8 1/20 0.36
ALDH1A1 P00352 3/20 0.35
SMPD3 Q9NY59 3/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 4/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
GAA P10253 1/20 0.33
TP53 P04637 2/20 0.33
LMNA P02545 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RECQL P46063 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
SCHEMBL3971459 0.87 CRHR1 (0.63) CRHR1KDM4EHSD17B10PI4KBALDH1A1
SCHEMBL3962354 0.83 CRHR1 (0.61) CRHR1KDM4EHSD17B10PI4KBALDH1A1
SCHEMBL3970101 0.83 CRHR1 (0.67) CRHR1KDM4EHSD17B10PI4KBALDH1A1
SCHEMBL3967590 0.79 CRHR1 (0.60) CRHR1KDM4EHSD17B10ALDH1A1SMPD3
SCHEMBL13763356 0.77 CRHR1 (0.64) CRHR1
SCHEMBL3967622 0.77 CRHR1 (0.64) CRHR1
SCHEMBL3967621 0.77 CRHR1 (0.64) CRHR1
SCHEMBL3967219 0.76 CRHR1 (0.71) CRHR1KDM4ESMPD3
SCHEMBL3963863 0.75 CRHR1 (0.69) CRHR1KDM4ESMPD3PTGDR2
SCHEMBL3967632 0.75 CRHR1 (1.00) CRHR1KDM4ESMPD3SMN1; SMN2MAPT

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-7557103-B2 Imidazopyridazine compounds ELI LILLY AND COMPANY (US) 2009-07-07 US disclosed
US-20080153828-A1 Imidazopyridazine Compounds ELI LILLY AND COMPANY 2008-06-26 US disclosed
EP-1879896-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2008-01-23 EP disclosed
WO-2006107784-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2006-10-12 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-20080153828-A1 Imidazopyridazine Compounds CRHR1, CRH, CRHR2 CRHR1 1/4885KDM4E 4385/4885HSD17B10 2537/4885

“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.