SCHEMBL9501829

SCHEMBL9501829

CC1(C)CC(N)C(C)(C)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.40
KDM1A O60341 7/20 0.40
MAOA P21397 7/20 0.38
HTR2C P28335 1/20 0.35
HTR2A P28223 2/20 0.34
SIGMAR1 Q99720 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
Benzene SCHEMBL5499312 0.98 MAOB (0.41) MAOBKDM1AMAOAHTR2CHTR2A
SCHEMBL9716878 0.77 HTR2C (0.36) MAOBKDM1AMAOAHTR2CHTR2A
SCHEMBL29662225 0.76 KDM1A (0.52) MAOBKDM1AMAOA
SCHEMBL10363387 0.75 HTR2C (0.35) MAOBKDM1AMAOAHTR2CHTR2A
SCHEMBL30388895 0.75 HTR2C (0.35) MAOBKDM1AMAOAHTR2CHTR2A
SCHEMBL19019983 0.73 HTR2C (0.34) MAOBKDM1AMAOAHTR2C
SCHEMBL11295093 0.72 KDM1A (0.46) MAOBKDM1AHTR2ASIGMAR1
SCHEMBL21845155 0.72 KDM1A (0.46) MAOBKDM1AHTR2ASIGMAR1
SCHEMBL17963525 0.72 KDM1A (0.55) MAOBKDM1AMAOA
SCHEMBL28259691 0.72 HTR2C (0.33) MAOBKDM1AMAOAHTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335375-B1 ANTIHYPERLIPIDEMIC AND ANTIATHEROSCLEROTIC COMPOUNDS AND COMPOSITIONS WARNER-LAMBERT COMPANY (US) 1993-06-09 EP disclosed
US-5030653-A N-2,6-dialkyl- or n-2,6-dialkoxyphenyl-n-arylalkylurea compounds WARNER-LAMBERT COMPANY (US) 1991-07-09 US disclosed
US-4999373-A Phenyl ureas or thioureas substituted with a xanthene or thioxanthene group WARNER-LAMBERT COMPANY (US) 1991-03-12 US disclosed
US-4948806-A N-2,6-DIALKYL-OR N-2,6-DIALKOXYPHENYL-N'-ARYLALKYLUREA WARNER-LAMBERT COMPANY (US) 1990-08-14 US disclosed
EP-0335375-A2 Antihyperlipidemic and antiatherosclerotic compounds and compositions WARNER-LAMBERT COMPANY (US) 1989-10-04 EP disclosed
US-4868210-A PHENYL UREAS AND PHENYL THIOUREAS WARNER-LAMBERT COMPANY (US) 1989-09-19 US disclosed