SCHEMBL21858992

SCHEMBL21858992

CCOC(=O)c1cc(Cc2ccc(Br)cc2)c2cccn2n1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.53
PDE3B Q13370 3/20 0.49
PDE3A Q14432 3/20 0.49
SPR P35270 2/20 0.44
ELANE P08246 1/20 0.40
ALOX5 P09917 1/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL22322792 0.89 CHRM1 (0.48) CHRM1PDE3BPDE3ASPRELANE
SCHEMBL21858970 0.85 CHRM1 (0.59) CHRM1SMN1; SMN2
SCHEMBL30436296 0.82 CHRM1 (0.57) CHRM1PDE3BPDE3A
SCHEMBL25348205 0.82 SPR (0.49) SPRELANEALDH1A1SMN1; SMN2
SCHEMBL21859079 0.82 CHRM1 (0.64) CHRM1SPR
SCHEMBL21938332 0.81 CHRM1 (0.61) CHRM1SPR
SCHEMBL28573813 0.78 SPR (0.47) SPRELANE
SCHEMBL21938331 0.78 CHRM1 (0.40) CHRM1SPRSMN1; SMN2
SCHEMBL25348758 0.78 SPR (0.44) SPRALDH1A1SMN1; SMN2
SCHEMBL21859083 0.78 CHRM1 (0.66) CHRM1SMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12122779-B2 Pyrrolo-pyridazine derivatives as muscarinic M1 receptor positive allosteric modulators SUVEN LIFE SCIENCES LIMITED (IN) 2024-10-22 US disclosed
EP-3867254-B1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2023-05-31 EP disclosed
EP-3867254-B1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2023-05-31 EP disclosed
US-20210340148-A1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2021-11-04 US disclosed
WO-2020079606-A9 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2020-08-13 WO disclosed
WO-2020079606-A9 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2020-08-13 WO disclosed
WO-2020079606-A1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2020-04-23 WO disclosed
WO-2020079606-A1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2020-04-23 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 (2 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-20210340148-A1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS CHRM1, CHRM5, CHRM2 CHRM1 1/4885PDE3B 1485/4885PDE3A 877/4885
US-12122779-B2 Pyrrolo-pyridazine derivatives as muscarinic M1 receptor positive allosteric modulators CHRM1, CHRM5, CHRM2 CHRM1 1/4885PDE3B 1485/4885PDE3A 877/4885

“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.