Pyrrole

Pyrrole

SCHEMBL28207656

Cc1c[nH]c(-c2ccccc2)n1.c1cc[nH]c1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
GAA P10253 2/20 0.45
MTOR P42345 1/20 0.40
ADK P55263 1/20 0.40
NISCH Q9Y2I1 1/20 0.40
HPGDS O60760 1/20 0.37
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
POLB P06746 2/20 0.37
PIN1 Q13526 1/20 0.37
KDM4E B2RXH2 3/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DCUN1D1 Q96GG9 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CXCR2 P25025 1/20 0.35
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 2/20 0.34
KMT2A Q03164 2/20 0.34

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
SCHEMBL49612 0.91 GAA (0.52) MAPTGAAMTORADKNISCH
Phosphine SCHEMBL28142196 0.89 GAA (0.50) MAPTGAAMTORADKNISCH
SCHEMBL28329121 0.85 GAA (0.47) MAPTGAAMTORADKNISCH
Octane SCHEMBL28114785 0.83 GAA (0.42) MAPTGAANR1H3
Imidazole SCHEMBL28039995 0.82 GAA (0.40) MAPTGAAMTORADKNISCH
Pyridine SCHEMBL28941369 0.82 GAA (0.45) MAPTGAAMTORADKNISCH
2-Phenylimidazole SCHEMBL16347705 0.81 NISCH (0.68) MAPTGAAMTORADKNISCH
SCHEMBL28159967 0.81 TSHR (0.40) MAPTGAANR1H3KDM4EMEN1
Carbamic Acid SCHEMBL29249439 0.81 MAPT (0.47) MAPTGAAPOLBPIN1KDM4E
SCHEMBL28201939 0.81 GAA (0.44) MAPTGAAMTORADKNISCH

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-107793701-A Thermosetting epoxy resin composition 信越化学工业株式会社 2018-03-13 CN disclosed