Pyrrole

Pyrrole

SCHEMBL9109239

Cn1cccc1C=O.c1cc[nH]c1

nearest known ligand 0.80

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.80
TRIM33 Q9UPN9 1/20 0.80
ALDH1A1 P00352 9/20 0.42
KMT2A Q03164 8/20 0.42
MAPT P10636 7/20 0.42
MEN1 O00255 6/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
USP2 O75604 3/20 0.42
GAA P10253 3/20 0.42
TLR9 Q9NR96 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
PARP1 P09874 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
ATM Q13315 1/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL260478 0.89
Bromide SCHEMBL28725516 0.87
Pyridine SCHEMBL28108416 0.77 TRIM24 (0.74) TRIM24TRIM33ALDH1A1KMT2AMAPT
Ammonia Solution, Strong SCHEMBL7802642 0.73 TRIM24 (0.67) TRIM24TRIM33ALDH1A1KMT2AMAPT
SCHEMBL15871031 0.71 TRIM24 (0.65) TRIM24TRIM33ALDH1A1KMT2AMAPT
SCHEMBL6762457 0.70
SCHEMBL6650788 0.70 TRIM24 (0.61) TRIM24TRIM33ALDH1A1KMT2AMAPT
SCHEMBL11661098 0.69 TRIM24 (0.63) TRIM24TRIM33ALDH1A1KMT2AMAPT
SCHEMBL15332238 0.69 TRIM24 (0.63) TRIM24TRIM33ALDH1A1KMT2AMAPT
SCHEMBL9225514 0.68 TRIM24 (0.55) TRIM24TRIM33ALDH1A1GAARAB9A

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-0527186-A4 UNIV ILLINOIS (US) 1995-01-18 EP disclosed
EP-0527186-A1 PHOTODYNAMIC PLANT DEFOLIANTS AND CHLOROPHYLL BIOSYNTHESIS MODULATORS The Board of Trustees for the University of Illinois (US) 1993-02-17 EP disclosed
WO-1991016820-A1 PHOTODYNAMIC PLANT DEFOLIANTS AND CHLOROPHYLL BIOSYNTHESIS MODULATORS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 1991-11-14 WO disclosed