Pyrrole

Pyrrole

SCHEMBL9864136

CCOC(=O)c1c(-c2ccccc2)c[nH]c1C.c1cc[nH]c1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.66
SMN1; SMN2 Q16637 3/20 0.56
ALDH1A1 P00352 8/20 0.48
HPGD P15428 6/20 0.48
GAA P10253 5/20 0.48
KDM4E B2RXH2 4/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPT P10636 6/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
LMNA P02545 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
HSD17B10 Q99714 2/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL9805088 0.94 HTT (0.73) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL11169340 0.82 HTT (0.68) HTTSMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL8061323 0.81 HTT (0.54) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL31619940 0.81 PRKCZ (0.56) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL11184909 0.80 HTT (0.64) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL9805097 0.80 HTT (1.00) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL4461121 0.78 HTT (0.51) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL27699148 0.78 ALDH1A1 (0.58) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL10748815 0.77 MAPT (0.55) HTTSMN1; SMN2ALDH1A1HPGDGAA
SCHEMBL154900 0.76 HTT (0.49) HTTSMN1; SMN2ALDH1A1HPGDGAA

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-0419792-A1 Pyrroles as costabilizers for vinylchloride polymerisate based mouldings HÜLS AKTIENGESELLSCHAFT (DE) 1991-04-03 EP disclosed
EP-0419794-A1 Costabilizers for vinyl chloride polymerisate based mouldings HÜLS AKTIENGESELLSCHAFT (DE) 1991-04-03 EP disclosed