SCHEMBL3694422

SCHEMBL3694422

O=C1C=CC(=O)N1c1ccc(Br)c(Br)c1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 18/20 0.59
▸ FAAH O00519 9/20 0.59
▸ HSP90AA1 P07900 4/20 0.52
▸ PKM P14618 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ G6PD P11413 1/20 0.46
▸ TLR9 Q9NR96 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ ATM Q13315 1/20 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
SCHEMBL10587190 0.83 MGLL (0.57) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL10585998 0.83 MGLL (0.57) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL15758246 0.82 MGLL (0.53) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL15758334 0.82 NPSR1 (0.56) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL3180754 0.82 TSHR (0.54) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL30645224 0.82 MGLL (0.53) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL14381240 0.77 MGLL (0.48) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL3198851 0.77 ALKBH5 (0.49) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL95324 0.75 MGLL (1.00) MGLLFAAHHSP90AA1PKMMAPK1
SCHEMBL19512050 0.75 HSP90AA1 (0.83) MGLLFAAHHSP90AA1PKMMAPK1

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-117321091-B Maleimide resin, amine resin, curable resin composition, and cured product thereof 日本化药株式会社 2024-06-04 — — CN disclosed
CN-117321091-A Maleimide resin, amine resin, curable resin composition, and cured product thereof 日本化药株式会社 2023-12-29 — — CN disclosed
CN-105418937-A Twelve-arm single-white-light star polymer and preparation method thereof UNIV FUJIAN 2016-03-23 — — CN disclosed
EP-2396003-A2 A COMPOSITION COMPRISING (-)-TRANS-3-(5,6-DIHYDRO-4H-PYRROLO [3,2,1-IJ] QUINOLIN-1-YL)-4-(1H-INDOL-3-YL) PYRROLIDINE-2, 5-DIONE IN COMBINATION WITH A SECOND ANTI-PROLIFERATIVE AGENT, ArQule, Inc. (US) 2011-12-21 — — EP disclosed
WO-2010093789-A2 COMBINATIONAL COMPOSITIONS AND METHODS FOR TREATMENT OF CANCER ARQULE, INC. (US) 2010-08-19 — — WO disclosed
EP-1846406-A1 MALEIMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATMENT OF CANCER ArQule, Inc. (US) 2007-10-24 — — EP disclosed
WO-2006086484-A1 MELEIMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATMENT OF CANCER ARQULE, INC. (US) 2006-08-17 — — WO disclosed
EP-0303782-B1 Resin Composition SUMITOMO DOW LTD (JP) 1995-01-11 — — EP disclosed
EP-0267574-B1 HEAT RESISTANT COPOLYMER COMPOSITION Sumitomo Dow Limited (JP) 1993-09-01 — — EP disclosed
US-4877833-A BLEND OF POLYMERS OF SPECIFIC COMPOSITION SUMITOMO NAUGATUCK CO., LTD. (JP) 1989-10-31 — — US disclosed
EP-0303782-A2 Resin Composition Sumitomo Dow Limited (JP) 1989-02-22 — — EP disclosed
EP-0267574-A2 Heat resistant copolymer composition Sumitomo Dow Limited (JP) 1988-05-18 — — EP disclosed
Send feedback