SCHEMBL21859079

SCHEMBL21859079

CCOC(=O)c1cc(Cc2ccc(-c3cnn(C)c3)cc2)c2cccn2n1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 14/20 0.64
CCNC P24863 4/20 0.41
CDK8 P49336 4/20 0.41
SPR P35270 1/20 0.41
COMT P21964 1/20 0.37

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
SCHEMBL21859057 0.88 CHRM1 (0.70) CHRM1CCNCCDK8
SCHEMBL21858935 0.86 CHRM1 (0.68) CHRM1CCNCCDK8
SCHEMBL21858992 0.82 CHRM1 (0.53) CHRM1SPR
SCHEMBL22322792 0.82 CHRM1 (0.48) CHRM1SPR
SCHEMBL21938242 0.81 CHRM1 (0.75) CHRM1CCNCCDK8
SCHEMBL21859069 0.81 CHRM1 (0.65) CHRM1CCNCCDK8
SCHEMBL21938332 0.80 CHRM1 (0.61) CHRM1SPR
SCHEMBL20917729 0.79 CHRM1 (0.44) CHRM1CCNCCDK8
SCHEMBL21859068 0.79 CHRM1 (0.65) CHRM1CCNCCDK8
SCHEMBL21859103 0.78 CHRM1 (1.00) CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3867254-B1 PYRROLO-PYRIDAZINE DERIVATIVES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2023-05-31 EP disclosed
CN-113166160-A Pyrrolopyridazine derivatives as positive allosteric modulators of muscarinic M1 receptors 苏文生命科学有限公司 2021-07-23 CN 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