SCHEMBL5240585

SCHEMBL5240585

Brc1cccc(CCCc2cccc(Br)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.68
▸ IDO1 P14902 2/20 0.54
▸ AGXT P21549 2/20 0.54
▸ MAOB P27338 1/20 0.50
▸ SIGMAR1 Q99720 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2D6 P10635 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46

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
SCHEMBL5139428 0.93 TAAR1 (0.61) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL19524669 0.93 TAAR1 (0.65) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL4399626 0.90 TAAR1 (0.74) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL13569139 0.89 TAAR1 (0.61) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL82275 0.89 TAAR1 (0.61) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL1044622 0.87 TAAR1 (0.59) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL11134683 0.87 TAAR1 (0.59) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL81535 0.87 TAAR1 (0.59) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL1042388 0.87 TAAR1 (0.59) TAAR1IDO1AGXTMAOBSIGMAR1
SCHEMBL237142 0.87 TAAR1 (0.77) TAAR1IDO1AGXTMAOBSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018004235-A1 ENCAPSULATING COMPOUND AND COMPOSITION FOR ORGANIC ELECTROLUMINESCENT DEVICE, AND ENCAPSULATED DEVICE INCLUDING SAME 덕산네오룩스 주식회사 2018-01-04 — — WO disclosed
WO-2017176011-A1 COMPOUND FOR ENCAPSULATING ORGANIC ELECTROLUMINESCENT DEVICE, COMPOSITION, AND ENCAPSULATED DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2017-10-12 — — WO disclosed
WO-2017176011-A1 COMPOUND FOR ENCAPSULATING ORGANIC ELECTROLUMINESCENT DEVICE, COMPOSITION, AND ENCAPSULATED DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2017-10-12 — — WO disclosed
WO-2011093463-A1 COMPOUND HAVING TRIMETHYLENE STRUCTURE, POLYMER COMPOUND CONTAINING UNIT THAT HAS TRIMETHYLENE STRUCTURE, AND REACTIVE COMPOUND HAVING TRIMETHYLENE STRUCTURE 日立化成工業株式会社 (JP) 2011-08-04 — — WO disclosed
EP-1298176-B1 Stacked film insulating film and substrate for semiconductor JSR CORP (JP) 2007-01-03 — — EP disclosed
US-6824833-B2 STACKED DIELECTRIC JSR CORPORATION (JP) 2004-11-30 — — US disclosed
US-20030077461-A1 Stacked film, insulating film and substrate for semiconductor JSR CORPORATION (JP) 2003-04-24 — — US disclosed
EP-1298176-A2 Stacked film insulating film and substrate for semiconductor JSR Corporation (JP) 2003-04-02 — — EP disclosed
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