SCHEMBL3973096

SCHEMBL3973096

CCC(CC)c1cc(C)nn2c(-c3sc4ncccc4c3Cl)c(C)nc12

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.55
CRHR2 Q13324 1/20 0.52
THRB P10828 1/20 0.31
PDE10A Q9Y233 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 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
SCHEMBL3959632 0.90 CRHR1 (0.65) CRHR1CRHR2THRBPDE10APOLB
SCHEMBL3962844 0.89 CRHR1 (0.55) CRHR1CRHR2THRBPDE10APOLB
SCHEMBL3972523 0.85 CRHR1 (0.58) CRHR1CRHR2
SCHEMBL3966632 0.84 CRHR1 (0.52) CRHR1CRHR2THRBPDE10APOLB
SCHEMBL4694319 0.81 CRHR1 (0.37) CRHR1CRHR2PDE10APOLBKMT2A
SCHEMBL3965286 0.80 CRHR1 (0.52) CRHR1CRHR2POLB
SCHEMBL3959459 0.78 CRHR1 (0.65) CRHR1CRHR2
SCHEMBL3922576 0.78 CRHR1 (0.54) CRHR1CRHR2
SCHEMBL3924625 0.78 CRHR1 (0.57) CRHR1CRHR2
SCHEMBL3923509 0.77 CRHR1 (0.52) CRHR1CRHR2

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 8 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-7557103-B2 Imidazopyridazine compounds ELI LILLY AND COMPANY (US) 2009-07-07 US disclosed
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
US-20080153828-A1 Imidazopyridazine Compounds ELI LILLY AND COMPANY 2008-06-26 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 1/4885CRHR2 3/4885THRB 501/4885

“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.