SCHEMBL8871887

SCHEMBL8871887

N#Cc1c(Br)c(Br)n(Cc2ccccc2)c1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
TSHR P16473 3/20 0.45
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.41
MITF O75030 1/20 0.41
HTT P42858 1/20 0.41
PDE9A O76083 1/20 0.40
PDE1C Q14123 1/20 0.40
MAPT P10636 1/20 0.39
CYP19A1 P11511 1/20 0.39
KDM4E B2RXH2 2/20 0.39

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
SCHEMBL9227531 0.75 CFTR (0.44) ARMEN1KMT2ATSHRALDH1A1
SCHEMBL10589837 0.75 KDM4E (0.39) ARMEN1KMT2ATSHRALDH1A1
SCHEMBL8991102 0.70 DYRK1A (0.56) MEN1KMT2ATSHRNPC1HTT
SCHEMBL4226153 0.70 DPP4 (0.58) MEN1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL9120609 0.70 AR (0.47) ARMEN1KMT2ATSHRALDH1A1
SCHEMBL8872265 0.70 KDM4E (0.39) KDM4ELMNA
SCHEMBL9120983 0.67 L3MBTL1 (0.31)
SCHEMBL9157389 0.67 KDM4E (0.51) ARMEN1KMT2ATSHRALDH1A1
SCHEMBL12895968 0.67 MEN1 (0.55) ARMEN1KMT2ATSHRALDH1A1
SCHEMBL9564330 0.66 MAPT (0.49) MEN1KMT2AALDH1A1NPSR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1043503-C Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID CO (US) 1999-06-02 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
CN-1029313-C Preparation method of pyrrole carbonitrile and nitropyrrole AMERICAN CYANAMID CO (US) 1995-07-12 CN 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
CN-1098590-A The application of pyrrole carbonitrile and nitro-pyrrole AMERICAN CYANAMID CO (US) 1995-02-15 CN 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
CN-1043317-A Pyrrolonitrile and nitropyrrole insecticides, acaricides and molluscicides and processes for their preparation AMERICAN CYANAMID CO (US) 1990-06-27 CN 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