SCHEMBL265052

SCHEMBL265052

CCOC(=O)c1cccc(Br)c1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.63
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 3/20 0.54
CDC25B P30305 3/20 0.50
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA7 P43166 3/20 0.50
CA9 Q16790 3/20 0.50
CA14 Q9ULX7 3/20 0.50
CYP1A2 P05177 2/20 0.49
KDM4E B2RXH2 3/20 0.47
RXFP1 Q9HBX9 2/20 0.47
F2R P25116 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CLEC4M Q9H2X3 1/20 0.47
CDC25A P30304 1/20 0.47
CDC25C P30307 1/20 0.47

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
SCHEMBL408906 0.85 TSHR (0.74) TSHRALDH1A1HSD17B10CDC25BKDM4E
SCHEMBL8178343 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10CDC25BCA12
SCHEMBL4626397 0.84 TSHR (0.61) TSHRALDH1A1HSD17B10CDC25BCA12
Bromide SCHEMBL15544606 0.84 TSHR (0.71) TSHRALDH1A1HSD17B10CDC25BKDM4E
SCHEMBL28628629 0.84 TSHR (0.71) TSHRALDH1A1HSD17B10CDC25BKDM4E
SCHEMBL18468247 0.84 TSHR (0.55) TSHRALDH1A1HSD17B10CA12CA1
SCHEMBL669621 0.83 TSHR (0.59) TSHRALDH1A1HSD17B10CDC25BCA12
SCHEMBL1188290 0.83 ALDH1A1 (0.60) TSHRALDH1A1HSD17B10CDC25BCA12
SCHEMBL27797134 0.83 TSHR (0.59) TSHRALDH1A1HSD17B10CDC25BCA12
SCHEMBL31257133 0.83 TSHR (0.59) TSHRALDH1A1HSD17B10CDC25BCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730940-B Heterocyclic substituted biphenyl compound and medical application thereof 中国药科大学 2024-08-30 CN disclosed
CN-116730940-A Heterocyclic substituted biphenyl compound and medical application thereof 中国药科大学 2023-09-12 CN disclosed
CN-106458860-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2019-07-26 CN disclosed
CN-106165684-B Pesticidal compositions and methods relating thereto 陶氏益农公司 2019-06-14 CN disclosed
CN-105622496-B Tetracycline compound 四相制药公司 2019-03-05 CN disclosed
EP-3092240-B1 ISOPROPYL TRIAZOLO PYRIDINE COMPOUNDS LILLY CO ELI (US) 2018-12-05 EP disclosed
CN-105025715-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-11-16 CN disclosed
CN-104981160-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-04-20 CN disclosed
CN-104981154-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2018-01-26 CN disclosed
CN-105899509-B Isopropyl triazolopyridine compounds 伊莱利利公司 2018-01-02 CN disclosed
WO-2005066139-A2 2-(AMINO-SUBSTITUTED)-4-ARYL PYRAMIDINES AND RELATED COMPOUNDS USEFUL FOR TREATING INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-07-21 WO disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 EP disclosed
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP disclosed
CN-1082790-C Herbicides RHONE POULENE AGRICULTURE LTD (GB) 2002-04-17 CN disclosed
EP-0625505-B1 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1998-10-28 EP disclosed
CN-1100261-A Herbicides RHONE POULENC AGRICULTURE (GB) 1995-03-22 CN disclosed
US-5374606-A Pre- and postemergence RHONE-POULENC AGRICULTURE LIMITED (GB) 1994-12-20 US disclosed
EP-0625505-A2 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP 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-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 TSHR 332/4885ALDH1A1 690/4885HSD17B10 907/4885

“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.