SCHEMBL2687014

SCHEMBL2687014

CCC(c1ccccc1)(c1ccccc1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.44
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PGR P06401 1/20 0.35
HTR7 P34969 1/20 0.34
HTR2B P41595 1/20 0.34
DRD2 P14416 2/20 0.33
DRD4 P21917 2/20 0.33
DRD3 P35462 2/20 0.33
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
GABRA4 P48169 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
SCHEMBL1539672 0.79 PNMT (0.46) PNMTNPC1RAB9APGRHTR7
SCHEMBL7111117 0.78 PNMT (0.46) PNMTNPC1RAB9APGRHTR7
SCHEMBL2043313 0.75 PNMT (0.49) PNMTNPC1RAB9APGRHTR7
SCHEMBL5837265 0.75 PNMT (0.49) PNMTNPC1RAB9APGRHTR7
SCHEMBL21758196 0.74 NPC1 (0.47) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL8060281 0.72 PNMT (0.41) PNMTNPC1RAB9APGRHTR7
SCHEMBL8971039 0.72 PNMT (0.46) PNMTNPC1RAB9APGRHTR7
SCHEMBL8861800 0.72 PNMT (0.54) PNMTNPC1RAB9APGRHTR7
SCHEMBL7877087 0.72 PNMT (0.49) PNMTNPC1RAB9APGRHTR7
SCHEMBL27942181 0.72 PNMT (0.49) PNMTNPC1RAB9AHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200240946-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GE INFRASTRUCTURE TECHNOLOGY LLC 2020-07-30 US disclosed
US-10634637-B2 Highly selective chemical and biological sensors GENERAL ELECTRIC COMPANY (US) 2020-04-28 US disclosed
US-20180045671-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GE INFRASTRUCTURE TECHNOLOGY LLC 2018-02-15 US disclosed
US-9638653-B2 Highly selective chemical and biological sensors GENERAL ELECTRICITY COMPANY (US) 2017-05-02 US disclosed
US-9494541-B2 Sensors for gas dosimetry GENERAL ELECTRICITY COMPANY (US) 2016-11-15 US disclosed
US-20160223484-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GE INFRASTRUCTURE TECHNOLOGY LLC 2016-08-04 US disclosed
US-9052263-B2 Methods for analyte detection GENERAL ELECTRIC COMPANY (US) 2015-06-09 US disclosed
US-9037418-B2 Highly selective chemical and biological sensors GENERAL ELECTRIC COMPANY (US) 2015-05-19 US disclosed
US-8990025-B2 Temperature-independent chemical and biological sensors GENERAL ELECTRIC COMPANY (US) 2015-03-24 US disclosed
US-20140025313-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GENERAL ELECTRIC COMPANY (US) 2014-01-23 US disclosed
US-20140019067-A1 TEMPERATURE-INDEPENDENT CHEMICAL AND BIOLOGICAL SENSORS GENERAL ELECTRIC COMPANY (US) 2014-01-16 US disclosed
US-8542023-B2 Highly selective chemical and biological sensors GENERAL ELECTRIC COMPANY (US) 2013-09-24 US disclosed
US-8542024-B2 Temperature-independent chemical and biological sensors GENERAL ELECTRIC COMPANY (US) 2013-09-24 US disclosed
US-8364419-B2 Sensor system and methods for selective analyte detection using resonance sensor circuit GENERAL ELECTRIC COMPANY (US) 2013-01-29 US disclosed
US-20120235690-A1 METHODS FOR ANALYTE DETECTION GENERAL ELECTRIC COMPANY (US) 2012-09-20 US disclosed
US-20120161787-A1 TEMPERATURE-INDEPENDENT CHEMICAL AND BIOLOGICAL SENSORS GENERAL ELECTRIC COMPANY (US) 2012-06-28 US disclosed
US-20120166095-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GENERAL ELECTRIC COMPANY (US) 2012-06-28 US disclosed
US-20120116683-A1 HIGHLY SELECTIVE CHEMICAL AND BIOLOGICAL SENSORS GENERAL ELECTRIC COMPANY (US) 2012-05-10 US disclosed
US-20100268479-A1 SENSOR SYSTEM AND METHODS FOR ANALYTE DETECTION GENERAL ELECTRIC COMPANY (US) 2010-10-21 US disclosed