SCHEMBL854090

SCHEMBL854090

BrCCCCCCCCCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.64
SIGMAR1 Q99720 9/20 0.58
MAOA P21397 1/20 0.56
MAOB P27338 2/20 0.54
MAPT P10636 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
HDAC1 Q13547 1/20 0.50

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
SCHEMBL7624612 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL1773132 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL7612611 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL7563162 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL11806608 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL2404356 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL2162933 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL79441 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL17027772 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT
SCHEMBL3310359 1.00 TDP1 (0.64) TDP1SIGMAR1MAOAMAOBMAPT

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106398080-A Aminated cross-linked segmented copolymer/graphene composite material and preparation method thereof 北京化工大学 2017-02-15 CN claimed
CN-113527341-A Alkane soluble tetrakis (pentafluorophenyl) borate and preparation method and application thereof 中国石油天然气股份有限公司 2021-10-22 CN disclosed
CN-106398080-B A kind of ammonium cross-linking type block copolymer/graphene composite material and preparation method thereof 北京化工大学 2018-12-04 CN disclosed
CN-106398080-A Aminated cross-linked segmented copolymer/graphene composite material and preparation method thereof 北京化工大学 2017-02-15 CN disclosed
EP-2740724-B1 COMPOUND FOR TREATING CARTILAGE DISORDERS ONO PHARMACEUTICAL CO (JP) 2016-12-28 EP disclosed
US-9085523-B2 Compound for treating cartilage disorders ONO PHARMACEUTICAL CO., LTD. (JP) 2015-07-21 US disclosed
EP-2432817-B1 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES RAYNERGY TEK INC (TW) 2015-02-11 EP disclosed
US-20140296485-A1 ANIONIC DISPLACER MOLECULES FOR HYDROPHOBIC DISPLACEMENT CHROMATOGRAPHY PNC BANK, NATIONAL ASSOCIATION 2014-10-02 US disclosed
US-20140171388-A1 COMPOUND FOR TREATING CARTILAGE DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 2014-06-19 US disclosed
EP-2740724-A1 COMPOUND FOR TREATING CARTILAGE DISORDERS ONO Pharmaceutical Co., Ltd. (JP) 2014-06-11 EP disclosed
WO-2010135701-A1 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES POLYERA CORPORATION (US) 2010-11-25 WO disclosed
EP-0637580-B1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL CO (JP) 2002-08-14 EP disclosed
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5817775-A HYDROFORMYLATION CATALYST CELANESE INTERNATIONAL CORPORATION (US) 1998-10-06 US disclosed
WO-1997030018-A1 2,2-DIFLUOROALKANE CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1997-08-21 WO disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed
EP-0153403-A4 CHEMICAL COMPOUNDS. MALLINCKRODT INC (US) 1985-12-11 EP disclosed
EP-0153403-A1 CHEMICAL COMPOUNDS Mallinckrodt, Inc. (a Delaware corporation) (US) 1985-09-04 EP disclosed
WO-1985000753-A1 CHEMICAL COMPOUNDS MALLINCKRODT, INC. (US) 1985-02-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140171388-A1 COMPOUND FOR TREATING CARTILAGE DISORDERS COL2A1, COL1A1, ADAMTS1 TDP1 2713/4885SIGMAR1 3831/4885MAOA 683/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.