SCHEMBL365955

SCHEMBL365955

COC(=O)c1ccc(CBr)cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 3/20 0.49
CYP4F2 P78329 2/20 0.49
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 6/20 0.46
GAA P10253 4/20 0.46
MAPT P10636 4/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
GLA P06280 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
ATM Q13315 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
PDK2 Q15119 1/20 0.43

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
SCHEMBL28203660 0.86 CYP4F2 (0.49) CYP4A11CYP4F2ALDH1A1MAPTHPGD
SCHEMBL29943277 0.86 ALDH1A1 (0.53) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL1022658 0.86 ALDH1A1 (0.53) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL5502090 0.86 ALDH1A1 (0.49) CYP4A11ALDH1A1KDM4EGAAMAPT
SCHEMBL7410301 0.85 CYP4F2 (0.68) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL498143 0.84 CA12 (0.52) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL5954327 0.84 CYP4A11 (0.46) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL4686032 0.83 ALDH1A1 (0.46) CYP4A11CYP4F2ALDH1A1KDM4EGAA
SCHEMBL13162022 0.83 CA12 (0.47) CYP4A11ALDH1A1KDM4EGAAMAPT
SCHEMBL3174714 0.83 LOXL2 (0.61) CYP4A11ALDH1A1KDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114414684-A Method for detecting flurarana intermediate and isomer thereof 丽珠集团新北江制药股份有限公司 2022-04-29 CN claimed
CN-109134295-A Amerantrone derivative and its preparation method and application 山东大学 2019-01-04 CN claimed
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2024-04-11 US disclosed
CN-117736182-A MetTL3 inhibitors and uses thereof 成都先导药物开发股份有限公司 2024-03-22 CN disclosed
US-20230416460-A1 COMPOUND, RESIN COMPOSITION, RESIN SHEET, RESIN CURED PRODUCT, AND LAMINATED SUBSTRATE TDK CORPORATION (JP) 2023-12-28 US disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
CN-116490355-A Compound, resin composition, resin sheet, resin cured product, and laminated substrate TDK株式会社 2023-07-25 CN disclosed
CN-114414684-B Florarana intermediate and detection method of isomer thereof 丽珠集团新北江制药股份有限公司 2023-05-23 CN disclosed
WO-2022263829-A1 COMPOUNDS AND THEIR USE FOR THE TREATMENT OF α1-ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-12-22 WO disclosed
CN-114414684-A Method for detecting flurarana intermediate and isomer thereof 丽珠集团新北江制药股份有限公司 2022-04-29 CN disclosed
US-10947210-B2 Inhibitors of Hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2021-03-16 US disclosed
US-4708441-A LIQUID CRYSTALS HOFFMAN-LA ROCHE INC. (US) 1987-11-24 US disclosed
US-4704005-A LIQUID CRYSTALS HOFFMANN-LA ROCHE INC. (US) 1987-11-03 US disclosed
US-4654371-A ANTI-OBESITY, HYPOGLYCEMIA AGENTS BEECHAM GROUP P.L.C. (GB) 1987-03-31 US disclosed
US-4613208-A ELECTROOPTICS; ULTRAVIOLET RADIATION STABILITY; QUICK RESPONSE HOFFMANN-LA ROCHE INC. (US) 1986-09-23 US disclosed
US-4595521-A In liquid crystalline carrier HOFFMANN-LA ROCHE INC. (US) 1986-06-17 US disclosed
US-4550981-A Liquid crystalline esters and mixtures HOFFMANN-LA ROCHE INC. (US) 1985-11-05 US disclosed
US-4478849-A HYPERGLYCEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1984-10-23 US disclosed
EP-0006735-B1 SECONDARY AMINES, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE BEECHAM GROUP PLC (GB) 1983-06-15 EP disclosed
EP-0006735-A1 Secondary amines, their preparation, pharmaceutical compositions containing them and their use BEECHAM GROUP PLC (GB) 1980-01-09 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 (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-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CYP4A11 3839/4885CYP4F2 2622/4885ALDH1A1 2407/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO CYP4A11 3816/4885CYP4F2 2691/4885ALDH1A1 2371/4885
US-10947210-B2 Inhibitors of Hepatitis C virus polymerase POLI, POLR2E, POLR2H CYP4A11 354/4885CYP4F2 803/4885ALDH1A1 114/4885

“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.