Pyrrole

Pyrrole

SCHEMBL28150602

CCC(=O)CC.c1cc[nH]c1.c1ccsc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43

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
Thiophene SCHEMBL27941681 0.89 TDP1 (0.56) TDP1
Pyrrole SCHEMBL27551713 0.86 TDP1 (0.59) TDP1
Pyrrole SCHEMBL27850771 0.84 TDP1 (0.56) TDP1
Pyrrole SCHEMBL28150564 0.83 TDP1 (0.30) TDP1
Pyrrole SCHEMBL1242717 0.78
Pyrrole SCHEMBL6901352 0.78
Pyrrole SCHEMBL29000 0.78
Pyrrole SCHEMBL28412073 0.78
Pyrrole SCHEMBL28861645 0.76 TDP1 (0.33) TDP1
Pyrrole SCHEMBL28543037 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106719710-A A kind of bactericidal composition containing fluorine thiazole pyrrole ethyl ketone 广东中迅农科股份有限公司 2017-05-31 CN disclosed