Pyrrole

Pyrrole

SCHEMBL28081091

O=C1OCCCC1O.c1cc[nH]c1

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.30
FKBP1A P62942 2/20 0.30
MEN1 O00255 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
SCHEMBL5818763 0.84
SCHEMBL8943397 0.84
SCHEMBL9807603 0.84
SCHEMBL5522044 0.78
Pyrimidine SCHEMBL28059133 0.77
Pyridine SCHEMBL28079839 0.77 TSHR (0.31)
SCHEMBL28049913 0.72 CA1 (0.32) FKBP1A
SCHEMBL12060316 0.72 TSHR (0.40) FKBP1A
SCHEMBL183974 0.71
SCHEMBL107295 0.71

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
CN-105814054-B Condensed imidazole and pyrazole derivatives as TNF active regulators UCB生物制药私人有限公司 2018-09-25 CN disclosed
CN-105814059-B Imidazo pyrimidine derivatives as TNF active regulators UCB生物制药私人有限公司 2018-04-03 CN disclosed
CN-105814046-B Imidazopyridine derivatives as TNF active regulators UCB生物制药私人有限公司 2018-01-30 CN disclosed
CN-105814061-B Imidazopyridazine derivative as TNF active regulators UCB生物制药私人有限公司 2018-01-26 CN disclosed
CN-105814059-A Imidazopyrimidine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814054-A Fused imidazole and pyrazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814061-A Imidazopyridazine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814046-A Imidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed