SCHEMBL4644670

SCHEMBL4644670

Oc1c(Cl)cc(Br)cc1Br

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
CYP3A4 P08684 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
GABRA1 P14867 1/20 0.56
GABRB1 P18505 1/20 0.56
GABRA2 P47869 1/20 0.56
GABRB2 P47870 1/20 0.56
ERN1 O75460 2/20 0.46
AKR1C4 P17516 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
HSD17B10 Q99714 3/20 0.43
TTR P02766 2/20 0.43
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.43
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
HPGD P15428 2/20 0.42

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
SCHEMBL442971 0.86 TSHR (0.58) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL2417306 0.81 TSHR (0.68) TSHRCYP3A4TDP1ERN1AKR1C4
SCHEMBL10922054 0.80 TSHR (0.46) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL18224 0.80 CYP3A4 (1.00) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL16599884 0.79 TSHR (0.43) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL29858952 0.77 CYP3A4 (0.93) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL4340169 0.77 CYP3A4 (0.93) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL10546483 0.77 CYP3A4 (0.93) TSHRCYP3A4TDP1GABRA1GABRB1
Hydrogen Sulfide SCHEMBL27992646 0.77 CYP3A4 (0.93) TSHRCYP3A4TDP1GABRA1GABRB1
SCHEMBL11020186 0.77 CYP3A4 (0.93) TSHRCYP3A4TDP1GABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11421223-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2022-08-23 US disclosed
CN-109111461-B Novel compound and application thereof in electroluminescent device 北京鼎材科技有限公司 2021-09-10 CN disclosed
US-20190309289-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2019-10-10 US disclosed
US-10370654-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2019-08-06 US disclosed
CN-109678115-A A method of extracting bromine from the brominated waste of pesticide producing 山东科源化工有限公司 2019-04-26 CN disclosed
US-20180320170-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2018-11-08 US disclosed
US-9944925-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. 2018-04-17 US disclosed
US-20160186168-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2016-06-30 US disclosed
EP-3027754-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING enEvolv, Inc. (US) 2016-06-08 EP disclosed
WO-2015017866-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. (US) 2015-02-05 WO disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed
US-4010252-A POLYQUATERNARY AMMONIUM COMPOUND, DEODORANTS COLGATE-PALMOLIVE COMPANY (US) 1977-03-01 US disclosed