Pyrrole

Pyrrole

SCHEMBL8874265

O=[N+]([O-])c1ccc[nH]1.c1cc[nH]c1

nearest known ligand 0.34

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
GAA P10253 2/20 0.34
KMT2A Q03164 2/20 0.34
PSMD14 O00487 1/20 0.34
MMP2 P08253 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
NFKB1 P19838 1/20 0.34
BLM P54132 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 4/20 0.33
FKBP5 Q13451 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL29064 0.91
Ammonia Solution, Strong SCHEMBL27520629 0.89
SCHEMBL28212565 0.89
Propanol SCHEMBL28143189 0.81 TSHR (0.34) LMNAMEN1GAAKMT2APSMD14
Guanidine SCHEMBL11136895 0.80 PRSS1 (0.39) LMNAMEN1GAAKMT2APSMD14
Pyrrole SCHEMBL27708626 0.73 ALDH1A1 (0.56) LMNAMEN1KMT2AHPGDALOX12
SCHEMBL28160564 0.72 MGLL (0.38) LMNAMEN1GAAKMT2APSMD14
Pyrrole SCHEMBL27814560 0.71 HSD17B10 (0.52) MEN1KMT2AHPGDSMN1; SMN2L3MBTL1
Nitrobenzene SCHEMBL27527397 0.70 ALDH1A1 (0.73) LMNAMEN1KMT2AHPGDALOX12
Pyrrole SCHEMBL7921169 0.69 MEN1 (0.38) MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102482337-A Muteins of the pyrroline-5-carboxylate reductase 1 AGENCY SCIENCE TECH & RES 2012-05-30 CN disclosed
CN-100360722-C Digital analysis APPLERA CORP (US) 2008-01-09 CN disclosed
CN-1608139-A Digital analysis APPLERA CORP (US) 2005-04-20 CN disclosed
US-5702681-A ADMINISTERING A NITROPYRROLE OR A PYRROLE CARBONITRILE COMPOUND AMERICAN CYANAMID COMPANY (US) 1997-12-30 US disclosed
US-5665759-A ADMINISTERING A NITROPYRROLE OR PYRROLE CARBONITRILE COMPOUND AMERICAN CYANAMID COMPANY (US) 1997-09-09 US disclosed
EP-0372263-B1 Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID CO (US) 1995-02-15 EP disclosed
US-5371239-A Pyrrole nitrile or nitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1994-12-06 US disclosed
EP-0557732-A1 Methods and compositions for protecting animals against attack and infestation by helminth, acarid and anthropod endo- and ectoparasites AMERICAN CYANAMID COMPANY (US) 1993-09-01 EP disclosed
US-5204332-A PYRROLE CARBONITRILE AND NITROPYRROLE INSECTICIDAL AND ACARICIDAL AND MOLLUSCICIDAL AGENTS AMERICAN CYANAMID COMPANY (US) 1993-04-20 US disclosed
US-5162308-A Pyrrole carbonitrile and nitropyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1992-11-10 US disclosed
EP-0372263-A2 Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1990-06-13 EP disclosed