Pyrrole

Pyrrole

SCHEMBL5264669

O=C(O)Oc1ccncn1.c1cc[nH]c1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.37
KMT2A Q03164 2/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
GFER P55789 1/20 0.35
CYP19A1 P11511 1/20 0.34
TBXA2R P21731 4/20 0.33
HSP90AA1 P07900 1/20 0.33
KDR P35968 2/20 0.33
BRAF P15056 1/20 0.33
MAPK14 Q16539 1/20 0.33
TNNI3K Q59H18 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
LMNA P02545 1/20 0.32
PLOD2 O00469 1/20 0.32
PLOD3 O60568 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL3657194 0.88 HSP90AA1 (0.41) P2RX7KMT2APKMHTTGFER
Pyrrole SCHEMBL3131650 0.80 LMNA (0.40) KMT2ALMNAALDH1A1CYP1A2L3MBTL1
Pyrrole SCHEMBL1706242 0.75 P2RX7 (0.51) P2RX7KMT2APKMHTTGFER
SCHEMBL12470613 0.72 HSP90AA1 (0.40) P2RX7KMT2APKMHSP90AA1KDR
SCHEMBL8390998 0.72 HSP90AA1 (0.45) P2RX7KMT2AHSP90AA1KDRBRAF
SCHEMBL2788170 0.72 P2RX7 (0.43) P2RX7KMT2APKMHTTGFER
SCHEMBL30606626 0.71 KMT2A (0.40) P2RX7KMT2AHSP90AA1LMNACYP1A2
SCHEMBL28145746 0.71 KMT2A (0.40) P2RX7KMT2AHSP90AA1LMNACYP1A2
SCHEMBL10376804 0.71 KMT2A (0.49) KMT2AHTTGFERLMNAALDH1A1
SCHEMBL30575119 0.70 HSP90AA1 (0.39) P2RX7KMT2APKMHSP90AA1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771448-A1 AZAINDOLE CARBOXAMIDES SCHWARZ PHARMA AG (DE) 2007-04-11 EP disclosed
WO-2006050976-A1 AZAINDOLE CARBOXAMIDES SCHWARZ PHARMA AG (DE) 2006-05-18 WO disclosed