SCHEMBL18525131

SCHEMBL18525131

O=C(O)N1Cc2cnc(NC3Cc4ccccc4C3)nc2C1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 17/20 0.69
MAPK1 P28482 3/20 0.50

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
SCHEMBL15875031 0.90 ENPP2 (0.82) ENPP2MAPK1
SCHEMBL19001278 0.87 ENPP2 (0.68) ENPP2MAPK1
SCHEMBL15874897 0.86 ENPP2 (0.64) ENPP2MAPK1
SCHEMBL29757402 0.86 ENPP2 (0.67) ENPP2MAPK1
SCHEMBL28413134 0.86 ENPP2 (0.50) ENPP2MAPK1
SCHEMBL28695082 0.86 ENPP2 (0.52) ENPP2MAPK1
SCHEMBL29607759 0.84 ENPP2 (0.64) ENPP2MAPK1
SCHEMBL15875559 0.84 ENPP2 (0.64) ENPP2MAPK1
SCHEMBL28710540 0.84 ENPP2 (0.64) ENPP2MAPK1
SCHEMBL16474043 0.83 ENPP2 (0.61) ENPP2

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
EP-2970254-B1 IMIDAZO PYRIDINE COMPOUNDS LILLY CO ELI (US) 2017-06-21 EP claimed
CN-113943296-A Pyrrolopyrimidine derivatives and uses thereof 武汉人福创新药物研发中心有限公司 2022-01-18 CN disclosed
EP-2943494-B1 PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN LILLY CO ELI (US) 2017-02-22 EP disclosed