SCHEMBL1033749

SCHEMBL1033749

Nc1cc2c(cc1Br)-c1ccccc1C2O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 4/20 0.43
HTR7 P34969 2/20 0.43
PGR P06401 1/20 0.40
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
DYRK1A Q13627 1/20 0.37
HRH3 Q9Y5N1 1/20 0.35
HKDC1 Q2TB90 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33

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
SCHEMBL26023533 0.85 PGR (0.44) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL18385982 0.79 HTR2B (0.50) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL5523779 0.76 PGR (0.44) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL26631822 0.76 HKDC1 (0.32) MEN1KMT2AHKDC1HTR2AL3MBTL1
SCHEMBL30441120 0.74 HTR2B (0.47) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL20082694 0.74 CYP1A2 (0.53) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL1075715 0.74 HTR2B (0.51) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL22336275 0.74 HTR2B (0.47) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL29884836 0.74 MAOA (0.52) HTR2BHTR7PGRALDH1A1MEN1
SCHEMBL216862 0.74 MAOA (0.52) HTR2BHTR7PGRALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663030-A A PHENYL OR NORBORNANE DERIVATIVE AS AN ADDITIVE TO REDUCE HEAT AND ENERGY REQUIRED TO FUSE THE TONER AND TO REDUCE JAMMING OF THE EQUIPMENT XEROX CORPORATION (US) 1997-09-02 US claimed
US-20240092744-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF THE NATIONAL INSTITUTES OF PHARMACEUTICAL R&D CO., LTD (CN) 2024-03-21 US disclosed
CN-114981275-B Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2023-12-19 CN disclosed
EP-4273150-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF The National Institutes of Pharmaceutical R&D Co., Ltd (CN) 2023-11-08 EP disclosed
EP-4273150-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF The National Institutes of Pharmaceutical R&D Co., Ltd (CN) 2023-11-08 EP disclosed
CN-114981275-A Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2022-08-30 CN disclosed
WO-2022143489-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2022-07-07 WO disclosed
EP-2277124-B1 MEANS FOR TREATING MYOSIN-RELATED DISEASES HANNOVER MED HOCHSCHULE (DE) 2016-11-09 EP disclosed
US-8536242-B2 Photocurable composition SEKISUI CHEMICAL CO., LTD. (JP) 2013-09-17 US disclosed
US-20110105554-A1 MEANS FOR TREATING MYOSIN-RELATED DISEASES KINARIS BIOMEDICALS GMBH (DE) 2011-05-05 US disclosed
US-20110097669-A1 PHOTOCURABLE COMPOSITION SEKISUI CHEMICAL CO., LTD. (JP) 2011-04-28 US disclosed
EP-2277124-A2 MEANS FOR TREATING MYOSIN-RELATED DISEASES KINARIS Biomedicals GmbH (DE) 2011-01-26 EP disclosed
US-20090318711-A1 Non-Covalent Inhibitors of AmpC ß-Lactamase SHOICHET BRIAN K 2009-12-24 US disclosed
US-20090318711-A1 Non-Covalent Inhibitors of AmpC ß-Lactamase SHOICHET BRIAN K 2009-12-24 US disclosed
US-7541381-B2 Non-covalent inhibitors of AmpC β-lactamase NORTHWESTERN UNIVERSITY (US) 2009-06-02 US disclosed
US-7541381-B2 Non-covalent inhibitors of AmpC β-lactamase NORTHWESTERN UNIVERSITY (US) 2009-06-02 US disclosed
WO-2009065600-A2 MEANS FOR TREATING MYOSIN-RELATED DISEASES Technische Universität Dresden (DE) 2009-05-28 WO disclosed
US-20070072096-A1 Negative curable dye-containing composition, color filter, and method of manufacturing the same FUJI PHOTO FILM CO., LTD. 2007-03-29 US 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 (3 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-20090318711-A1 Non-Covalent Inhibitors of AmpC ß-Lactamase AMPD1, AMPD2, AMPD3 HTR2B 4470/4885HTR7 4837/4885PGR 4711/4885
US-20110105554-A1 MEANS FOR TREATING MYOSIN-RELATED DISEASES MYH14, MYH2, MYLK2 HTR2B 3314/4885HTR7 2648/4885PGR 4453/4885
US-20240092744-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF GOT2, HADH, CYP4A11 HTR2B 1543/4885HTR7 584/4885PGR 1886/4885

“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.