SCHEMBL10366198

SCHEMBL10366198

O=C(Nc1ccc(C(=O)Cl)cc1)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
KDM1A O60341 3/20 0.61
MAOA P21397 2/20 0.61
MAOB P27338 2/20 0.61
RCOR1 Q9UKL0 2/20 0.60
TP53 P04637 2/20 0.59
MAPT P10636 2/20 0.59
MGLL Q99685 1/20 0.57
ROCK2 O75116 1/20 0.56
RAB9A P51151 4/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 1/20 0.55
NPC1 O15118 3/20 0.54
ALDH1A1 P00352 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TSHR P16473 1/20 0.54
ATM Q13315 1/20 0.54
DNMT1 P26358 1/20 0.52
DNMT3A Q9Y6K1 1/20 0.52
NAMPT P43490 1/20 0.51

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
SCHEMBL3694153 0.88 POLB (0.68) POLBKDM1AMAOAMAOBRCOR1
Benzyl Phenylcarbamate SCHEMBL1222943 0.85 POLB (0.78) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL15777029 0.85 TP53 (0.67) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL1160238 0.85 POLB (0.64) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL3795024 0.84 POLB (0.68) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL1870929 0.84 POLB (0.71) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL12348789 0.84 RAB9A (0.65) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL10642358 0.83 POLB (0.66) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL12045682 0.83 POLB (0.66) POLBKDM1AMAOAMAOBRCOR1
SCHEMBL10598558 0.83 POLB (0.69) POLBKDM1AMAOAMAOBRCOR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018037120-A1 PRODRUGS ACTIVATED BY REACTIVE OXYGEN SPECIES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES AND CANCER DANMARKS TEKNISKE UNIVERSITET (DK) 2018-03-01 WO disclosed
US-8486534-B2 Surface-modified polymer films BAR-ILAN UNIVERSITY (IL) 2013-07-16 US disclosed
EP-0140327-B1 BIS-DIOXOPIPERAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, ANTITUMOR AGENTS COMPRISING THEM AND COMPOSITIONS CONTAINING THEM ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1990-05-23 EP disclosed
US-4650799-A Bis-dioxopiperazine derivatives, process for their preparation, antitumor agents comprising them and compositions containing them ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1987-03-17 US disclosed
EP-0140327-A2 Bis-dioxopiperazine derivatives, process for their preparation, antitumor agents comprising them and compositions containing them ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-08 EP disclosed
US-4410696-A Antitumor and immunosuppressive 4-carbamoylimidazolium-5-olate derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-10-18 US disclosed
EP-0075629-A1 Imidazole derivatives, their preparation, and their pharmaceutical compositions Sumitomo Chemical Industries Ltd. (JP) 1983-04-06 EP disclosed
US-4196291-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1980-04-01 US disclosed
US-4141978-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1979-02-27 US disclosed
US-4113867-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1978-09-12 US disclosed
US-4001411-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-01-04 US disclosed